data_1l4s_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 1l4s _Structure_validation_residue.Date_analyzed 2016-10-06 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 8.2 ttp . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.736 0.303 . . . . 0.0 110.826 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -119.52 122.97 42.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.078 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 36.9 mt -120.68 125.54 74.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.849 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -134.02 160.71 36.92 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.862 0.363 . . . . 0.0 111.119 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 44.8 p -163.43 142.67 8.34 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.637 -179.533 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -102.47 31.25 4.15 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.002 -179.571 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -140.95 -48.0 0.41 Allowed 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.647 179.623 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -119.32 -174.29 2.69 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.638 179.72 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -114.33 167.63 10.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.618 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 5.0 mm -91.2 115.56 30.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.109 0.481 . . . . 0.0 111.085 -179.502 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 15.4 p -99.74 149.33 35.83 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.887 179.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_exo -56.39 -19.64 29.47 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.335 2.023 . . . . 0.0 111.919 179.216 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -77.75 -41.6 37.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.078 0.466 . . . . 0.0 110.284 179.234 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 22.9 mt -73.23 -29.1 27.22 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.367 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.517 178.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 13.3 ttp85 -74.12 -45.74 47.02 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.604 -0.726 . . . . 0.0 109.227 178.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 33.8 tt0 -67.46 -37.35 82.8 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.503 178.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.511 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 72.5 t60 -59.2 -62.49 1.85 Allowed 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 178.872 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 22.2 t -60.65 -46.56 95.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.609 -0.268 . . . . 0.0 110.536 178.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.669 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -57.06 -43.94 82.53 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.846 179.746 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.511 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 1.1 p30 -59.66 -33.34 71.42 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.95 0.405 . . . . 0.0 110.645 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 10.3 mmt180 -74.67 -28.16 60.72 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.058 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.669 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 2.4 mt -67.53 -52.77 34.94 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.151 0.5 . . . . 0.0 110.293 179.453 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.48 -25.45 66.06 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.217 179.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.94 -28.28 43.72 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.934 179.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 5.8 mt . . . . . 0 C--N 1.328 -0.361 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.0 -179.816 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_endo . . . . . 0 N--CA 1.464 -0.233 0 CA-C-O 120.768 0.237 . . . . 0.0 111.958 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -136.84 130.05 31.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.233 -179.66 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 3.4 mp -121.46 134.6 64.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.855 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 4.1 mp -116.95 146.04 21.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.999 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.8 mt -122.31 128.32 50.91 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.054 0.454 . . . . 0.0 111.023 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 5.3 m -123.99 -173.55 2.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.301 179.6 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.425 ' HG3' ' CD2' ' A' ' 47' ' ' PHE . 3.0 tttp -158.58 141.29 14.46 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.372 0.606 . . . . 0.0 111.43 -179.678 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -131.82 156.37 80.2 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-N 115.075 -0.966 . . . . 0.0 109.146 179.232 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_exo -51.73 -24.42 17.92 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 121.881 1.721 . . . . 0.0 112.382 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.72 -6.84 55.66 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.47 -0.786 . . . . 0.0 112.808 -179.148 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 149.68 -164.15 29.44 Favored Glycine 0 C--O 1.224 -0.501 0 C-N-CA 120.153 -1.022 . . . . 0.0 112.161 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.425 ' CD2' ' HG3' ' A' ' 42' ' ' LYS . 18.0 m-85 -108.19 152.63 24.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.544 0.688 . . . . 0.0 112.015 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 53.2 t -127.55 142.01 44.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 114.753 -1.112 . . . . 0.0 110.96 -179.23 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -132.45 124.88 29.45 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.986 179.666 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -117.7 149.5 40.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.436 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . 0.46 ' N ' HD12 ' A' ' 76' ' ' LEU . . . -146.02 142.06 28.26 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.905 0.383 . . . . 0.0 111.798 -179.728 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 4.4 m -134.35 134.04 41.33 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.278 179.651 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 3.4 mm -132.54 133.29 59.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.979 0.418 . . . . 0.0 111.16 -179.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 13.5 m-20 -102.98 130.86 50.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.427 179.02 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 7.3 p -128.6 165.74 29.38 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.749 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_exo -69.87 -8.98 24.96 Favored 'Trans proline' 0 CA--C 1.529 0.247 0 C-N-CA 122.703 2.269 . . . . 0.0 112.55 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -123.08 22.91 9.41 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 111.694 0.257 . . . . 0.0 111.694 -179.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 132.77 -167.42 23.23 Favored Glycine 0 C--N 1.331 0.255 0 C-N-CA 120.441 -0.885 . . . . 0.0 112.938 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 14.9 t -136.43 143.48 35.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.813 0.339 . . . . 0.0 110.943 -179.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.9 mt -115.55 155.72 27.05 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.981 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 21.4 t -140.19 148.03 22.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.312 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -153.73 146.52 24.33 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.045 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -146.16 155.72 42.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.744 -179.442 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -142.85 154.49 25.34 Favored Glycine 0 N--CA 1.452 -0.277 0 N-CA-C 111.181 -0.768 . . . . 0.0 111.181 179.128 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 19.6 mttt -147.59 42.92 1.08 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 117.239 0.519 . . . . 0.0 112.018 -179.336 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . 0.407 ' ND1' ' CG2' ' A' ' 71' ' ' THR . 12.8 t-80 -76.06 154.96 35.25 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.303 178.935 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -60.96 -26.14 67.32 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.727 0.299 . . . . 0.0 111.165 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -98.5 121.94 41.07 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.044 0.45 . . . . 0.0 111.433 -179.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.9 ttt -48.33 -49.18 35.17 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.802 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 42.2 m-85 -65.75 -37.6 86.83 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.44 -179.242 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.407 ' CG2' ' ND1' ' A' ' 66' ' ' HIS . 93.6 m -64.85 -40.42 95.14 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.792 0.329 . . . . 0.0 110.613 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.82 -48.28 81.31 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.624 179.552 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 10.3 mt -60.52 -43.0 93.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.839 0.352 . . . . 0.0 110.181 179.384 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -65.21 -39.65 93.08 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.212 179.099 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -66.64 -45.61 78.46 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.728 179.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.46 HD12 ' N ' ' A' ' 51' ' ' ALA . 0.2 OUTLIER -53.42 -61.09 2.52 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.554 -0.294 . . . . 0.0 110.284 179.479 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 62.4 mt -55.37 -28.19 21.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 C-N-CA 120.899 -0.32 . . . . 0.0 110.201 179.086 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -58.99 -38.0 78.15 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 177.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.25 -30.22 63.31 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 114.755 -1.112 . . . . 0.0 109.849 178.69 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 84.1 mt -63.31 -48.63 77.27 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 177.511 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -61.69 -49.44 76.46 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 114.625 -1.171 . . . . 0.0 110.52 177.801 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.07 -27.27 69.28 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.157 -179.77 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -75.38 -44.49 44.57 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.932 0.396 . . . . 0.0 110.686 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 3.5 mt -64.2 -26.46 68.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.71 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -63.6 -41.48 98.32 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.192 179.653 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 17.5 mmtt . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.285 179.907 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.7 tmt? . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.865 0.364 . . . . 0.0 110.906 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . 0.401 ' OD1' ' CE1' ' A' ' 37' ' ' HIS . 3.3 t-20 -127.76 109.38 11.59 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.278 -179.631 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 7.7 pt -118.19 128.66 75.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.702 179.561 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -134.0 165.85 24.07 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.229 -179.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 21.7 p -163.51 144.47 9.12 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.24 -179.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.77 -2.67 27.66 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.67 -179.54 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -98.85 -29.44 12.96 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 120.705 0.288 . . . . 0.0 111.041 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 34.6 mtm -143.41 178.79 7.51 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.032 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -98.74 163.88 12.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.69 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 5.0 mm -90.67 116.68 32.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.052 0.453 . . . . 0.0 111.05 -179.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 15.1 p -100.52 158.47 31.86 Favored Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.959 179.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_exo -63.32 -14.65 43.41 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.519 2.146 . . . . 0.0 111.911 179.091 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -84.49 -41.24 16.76 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-O 121.012 0.434 . . . . 0.0 110.434 179.507 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 34.6 mt -72.95 -30.5 32.44 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.299 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.284 178.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.444 ' O ' ' CB ' ' A' ' 20' ' ' ALA . 47.3 mtp180 -71.67 -47.11 56.45 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.502 178.551 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 19.4 tt0 -67.18 -36.07 80.99 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.557 178.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.471 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 56.6 t60 -60.13 -64.56 0.91 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.951 0.405 . . . . 0.0 110.025 178.933 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 23.3 t -61.34 -47.1 95.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.9 179.128 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.653 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -56.44 -47.06 79.9 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 111.751 0.278 . . . . 0.0 111.751 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.471 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 3.2 p30 -59.83 -29.1 68.04 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.705 -0.398 . . . . 0.0 110.447 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 17.2 mmm180 -75.7 -29.85 59.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.591 179.41 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.653 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 1.3 mt -68.17 -50.62 53.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.942 0.401 . . . . 0.0 110.272 179.183 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.33 -24.32 63.25 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.803 179.467 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 29.4 tttt -78.1 -32.49 50.58 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.409 179.238 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.33 -0.25 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.757 179.542 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo . . . . . 0 N--CA 1.462 -0.328 0 N-CA-C 111.326 -0.298 . . . . 0.0 111.326 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . 0.401 ' CE1' ' OD1' ' A' ' 3' ' ' ASN . 1.6 t-160 -134.0 128.43 34.36 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.123 0.487 . . . . 0.0 111.612 -179.397 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.406 ' N ' ' CD1' ' A' ' 38' ' ' ILE . 3.4 mp -120.73 135.63 60.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.594 179.491 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 26.5 mt -115.78 146.44 20.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.937 0.399 . . . . 0.0 111.254 -179.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.9 mt -119.86 128.68 53.89 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.808 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 9.2 m -125.5 -170.46 2.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.733 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.468 ' HA ' ' HA ' ' A' ' 47' ' ' PHE . 3.6 ttpm? -173.29 145.96 1.35 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.186 0.517 . . . . 0.0 110.762 -179.812 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.405 ' N ' ' HG2' ' A' ' 42' ' ' LYS . 5.5 mt-10 -131.0 170.47 11.15 Favored Pre-proline 0 C--N 1.324 -0.504 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.213 179.043 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_exo -51.62 -19.34 7.31 Favored 'Trans proline' 0 N--CA 1.463 -0.282 0 C-N-CA 121.786 1.658 . . . . 0.0 112.354 -179.332 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.01 -78.71 0.27 Allowed 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.905 179.094 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -141.16 -154.6 6.24 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.665 -179.281 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.468 ' HA ' ' HA ' ' A' ' 42' ' ' LYS . 20.1 m-85 -109.6 151.33 26.96 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 121.623 0.725 . . . . 0.0 112.726 -179.437 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.42 ' HA ' ' O ' ' A' ' 64' ' ' GLY . 54.9 t -124.61 142.93 39.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 114.511 -1.222 . . . . 0.0 110.48 -179.888 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -132.9 126.08 31.33 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.238 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -118.92 150.28 40.17 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.583 179.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . 0.446 ' N ' HD13 ' A' ' 76' ' ' LEU . . . -146.8 141.14 26.37 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.845 0.355 . . . . 0.0 111.657 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.2 m -135.79 130.83 34.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.024 179.45 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 13.4 mt -133.02 138.03 52.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 121.102 0.477 . . . . 0.0 111.785 -179.69 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 19.9 m-20 -102.05 119.25 38.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.723 179.362 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 10.6 p -112.23 156.3 42.24 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.453 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -63.48 -14.21 41.02 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 122.484 2.123 . . . . 0.0 112.619 -179.776 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 9.1 m120 -119.69 23.4 11.16 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.628 -0.26 . . . . 0.0 111.538 -179.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 137.07 -166.95 24.82 Favored Glycine 0 N--CA 1.453 -0.175 0 C-N-CA 120.488 -0.863 . . . . 0.0 112.902 179.791 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 15.0 t -135.91 142.91 37.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.828 0.347 . . . . 0.0 111.037 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 37.0 mt -116.98 152.75 33.94 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.11 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 21.5 t -139.91 146.78 24.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.067 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -153.58 150.64 28.88 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.074 0.464 . . . . 0.0 111.205 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 94.3 p -145.69 156.17 43.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.73 -179.212 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.42 ' O ' ' HA ' ' A' ' 48' ' ' VAL . . . -144.39 146.91 17.83 Favored Glycine 0 C--N 1.331 0.302 0 N-CA-C 111.06 -0.816 . . . . 0.0 111.06 179.034 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 8.1 mttt -141.21 43.8 1.78 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 117.212 0.506 . . . . 0.0 112.056 -178.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . 0.422 ' CG ' HG23 ' A' ' 71' ' ' THR . 12.9 t-80 -76.8 155.3 33.17 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.794 0.33 . . . . 0.0 110.436 178.887 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -61.13 -26.66 67.84 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.323 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -97.93 123.62 42.0 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.027 0.441 . . . . 0.0 111.45 -179.34 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.3 ttt -48.06 -50.15 29.0 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.774 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 72.6 m-85 -66.32 -38.29 87.35 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.672 -179.037 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.422 HG23 ' CG ' ' A' ' 66' ' ' HIS . 87.2 m -64.51 -42.57 95.73 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.698 0.285 . . . . 0.0 110.82 -179.775 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.09 -47.42 86.38 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.516 179.575 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 13.0 mt -60.13 -45.39 95.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 120.959 0.409 . . . . 0.0 110.311 179.459 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -64.62 -39.0 92.92 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.364 179.475 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -65.24 -43.59 90.9 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.412 179.46 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.446 HD13 ' N ' ' A' ' 51' ' ' ALA . 0.2 OUTLIER -54.35 -57.34 11.64 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 179.065 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 8.7 mt -57.53 -30.58 36.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 N-CA-C 110.104 -0.332 . . . . 0.0 110.104 178.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -57.97 -37.78 74.82 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.561 0.696 . . . . 0.0 109.38 178.391 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -75.11 -28.9 60.41 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.708 -1.133 . . . . 0.0 109.935 178.873 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 99.3 mt -62.74 -49.45 74.98 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 177.424 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -62.29 -43.87 97.83 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 114.53 -1.214 . . . . 0.0 110.511 177.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 1.4 ptt180 -62.4 -34.61 77.07 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.638 -179.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 38.5 mt-30 -74.52 -39.22 62.51 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.478 179.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 19.3 mt -65.78 -26.01 67.51 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.846 179.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -63.93 -42.39 97.36 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.583 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.326 -0.426 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.051 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.9 tmm? . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.782 0.325 . . . . 0.0 110.862 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -121.01 111.13 17.09 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.142 -179.819 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.42 HD12 HG22 ' A' ' 4' ' ' ILE . 45.8 mt -110.68 125.6 67.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.848 179.65 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.8 p -134.04 160.58 37.31 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.123 179.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 39.3 p -163.5 140.54 7.25 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.462 -179.557 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.1 mttp -101.13 33.62 2.8 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.032 -179.615 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -140.62 -50.39 0.45 Allowed 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.53 179.584 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 7.7 mtm -120.6 -174.45 2.81 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.606 179.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -111.62 171.84 7.25 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.766 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.8 mm -90.93 112.6 25.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 121.063 0.459 . . . . 0.0 111.054 -179.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 15.9 p -98.69 153.05 38.09 Favored Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.886 179.608 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_exo -58.61 -17.1 33.38 Favored 'Trans proline' 0 C--N 1.345 0.342 0 C-N-CA 122.379 2.052 . . . . 0.0 111.879 179.139 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.34 -42.53 20.4 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-O 121.022 0.439 . . . . 0.0 110.44 179.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 36.1 mt -72.81 -28.34 26.97 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 CA-C-N 115.747 -0.661 . . . . 0.0 109.376 178.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 1.8 mmm180 -75.2 -46.27 35.05 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.627 178.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 51.9 tp60 -67.72 -38.53 83.73 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.714 179.096 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.502 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 81.2 t60 -60.11 -61.43 2.61 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 179.049 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.422 ' O ' ' HG ' ' A' ' 23' ' ' LEU . 29.7 t -60.75 -47.01 95.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 116.622 -0.263 . . . . 0.0 110.552 178.909 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.67 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -57.52 -42.64 83.21 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 111.753 0.279 . . . . 0.0 111.753 179.702 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.502 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 1.0 OUTLIER -59.96 -33.28 71.71 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 120.64 -0.424 . . . . 0.0 110.287 179.916 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 27.2 mmt180 -75.02 -28.03 60.32 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.056 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.67 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 3.6 mt -68.85 -54.05 17.92 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.004 0.43 . . . . 0.0 110.408 179.397 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.62 -24.31 63.71 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.813 -0.631 . . . . 0.0 111.188 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -79.5 -30.88 42.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.112 0.482 . . . . 0.0 110.286 179.41 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 37.2 mt . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.793 179.987 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_endo . . . . . 0 N--CA 1.462 -0.375 0 N-CA-C 111.279 -0.316 . . . . 0.0 111.279 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -109.7 132.46 54.12 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.119 0.485 . . . . 0.0 112.153 -178.904 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 10.8 mm -121.51 133.3 68.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.263 179.232 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 3.8 mt -123.77 139.2 51.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 120.981 0.419 . . . . 0.0 111.5 -179.375 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -116.93 128.1 54.88 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.727 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.2 m -124.2 -175.2 3.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.6 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.431 ' HG3' ' CD2' ' A' ' 47' ' ' PHE . 13.5 tttm -158.4 140.15 13.73 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.365 0.602 . . . . 0.0 111.157 -179.558 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 60.1 mt-10 -131.5 156.11 80.56 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 115.105 -0.952 . . . . 0.0 109.313 179.19 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_exo -51.5 -24.67 17.3 Favored 'Trans proline' 0 N--CA 1.464 -0.24 0 C-N-CA 121.906 1.737 . . . . 0.0 112.435 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -89.61 -6.69 56.01 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.437 -0.801 . . . . 0.0 112.749 -179.122 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 150.36 -163.9 29.64 Favored Glycine 0 C--O 1.225 -0.443 0 C-N-CA 120.227 -0.987 . . . . 0.0 112.275 179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.431 ' CD2' ' HG3' ' A' ' 42' ' ' LYS . 18.9 m-85 -109.07 154.43 22.26 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.559 0.695 . . . . 0.0 111.987 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 68.0 t -127.94 139.57 51.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 114.787 -1.097 . . . . 0.0 110.941 -179.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -131.14 124.06 29.89 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.597 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -120.08 147.03 45.36 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.658 0.266 . . . . 0.0 110.986 -179.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . 0.416 ' N ' HD11 ' A' ' 76' ' ' LEU . . . -144.35 140.92 29.39 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.829 0.347 . . . . 0.0 111.387 179.738 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.0 m -136.33 131.3 34.13 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.253 179.469 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 15.3 mt -132.45 135.59 57.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 120.865 0.364 . . . . 0.0 111.252 -179.604 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -104.11 121.16 42.65 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.648 179.372 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 7.6 p -116.29 155.03 48.83 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.622 179.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_exo -65.33 -11.92 32.44 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.515 2.143 . . . . 0.0 112.528 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 8.5 m-80 -112.37 -4.3 14.31 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 111.732 0.271 . . . . 0.0 111.732 -179.697 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 162.32 -166.98 36.72 Favored Glycine 0 C--N 1.331 0.27 0 C-N-CA 120.388 -0.91 . . . . 0.0 112.82 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 34.8 t -129.98 140.36 49.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 120.835 0.35 . . . . 0.0 111.134 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -118.34 142.58 47.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.818 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.433 ' O ' ' NE2' ' A' ' 83' ' ' GLN . 11.1 p -140.67 146.61 23.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.935 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -155.85 152.68 28.66 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.265 0.555 . . . . 0.0 111.698 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 67.1 m -143.23 160.46 40.43 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.709 -179.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -155.18 105.77 0.28 Allowed Glycine 0 CA--C 1.519 0.289 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.566 179.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.1 mtmp? -107.73 44.47 1.09 Allowed 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.1 0.408 . . . . 0.0 112.1 -178.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 14.6 t-80 -75.72 156.33 34.78 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.578 -0.283 . . . . 0.0 110.415 178.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -60.07 -27.28 66.84 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.673 0.273 . . . . 0.0 111.199 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -98.33 120.46 38.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.944 0.402 . . . . 0.0 111.475 -179.438 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 13.3 ttt -48.2 -46.72 35.4 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.591 179.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 44.3 m-85 -66.47 -40.97 89.63 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.293 -179.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 86.8 m -65.26 -38.68 91.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.746 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.13 -50.71 70.8 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.8 179.607 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 7.0 mt -61.53 -43.78 97.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.788 0.327 . . . . 0.0 110.352 179.543 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -63.52 -40.25 96.55 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.246 179.339 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.12 -42.68 88.84 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.381 179.367 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.416 HD11 ' N ' ' A' ' 51' ' ' ALA . 0.2 OUTLIER -52.19 -62.0 1.91 Allowed 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 109.881 -0.415 . . . . 0.0 109.881 179.036 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 46.3 mt -55.05 -30.29 23.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 178.71 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -59.55 -29.58 68.02 Favored 'General case' 0 N--CA 1.442 -0.856 0 CA-C-O 121.22 0.533 . . . . 0.0 110.298 178.188 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.98 -28.34 22.73 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.354 179.155 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 97.3 mt -63.7 -50.31 69.69 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 177.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -60.0 -50.67 72.83 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 114.907 -1.042 . . . . 0.0 111.057 177.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.52 -32.63 73.6 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.898 -179.349 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . 0.433 ' NE2' ' O ' ' A' ' 61' ' ' VAL . 41.4 mt-30 -74.2 -42.54 59.63 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.619 179.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.6 mt -65.55 -29.2 69.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.462 179.464 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -63.25 -28.25 69.9 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.568 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 25.9 mmtt . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.249 -179.818 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' MET . . . . . 0.426 ' CG ' ' CD1' ' A' ' 23' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.459 0.023 0 CA-C-O 120.83 0.348 . . . . 0.0 110.978 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -122.38 112.98 18.75 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.392 -179.7 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 34.8 mt -109.97 126.75 67.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.539 179.419 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -134.38 162.25 32.75 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.862 0.363 . . . . 0.0 111.133 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 38.9 p -164.36 136.27 4.63 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.548 -179.739 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.6 mtpp -102.33 18.68 20.4 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.195 -179.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -141.72 20.61 2.17 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 120.881 0.372 . . . . 0.0 110.927 179.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 177.31 -177.99 0.18 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.545 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -117.84 160.22 21.77 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.855 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 3.4 mm -92.28 118.54 38.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.012 -179.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 13.7 p -100.11 149.87 36.39 Favored Pre-proline 0 C--N 1.326 -0.424 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.701 179.528 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -56.23 -18.99 25.84 Favored 'Trans proline' 0 C--N 1.343 0.288 0 C-N-CA 122.4 2.067 . . . . 0.0 112.131 179.405 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.78 -39.93 25.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.069 0.461 . . . . 0.0 110.443 179.485 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 21.5 mt -72.93 -31.69 36.86 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.216 178.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.422 ' O ' ' CB ' ' A' ' 20' ' ' ALA . 0.2 OUTLIER -72.14 -47.37 51.49 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.537 178.854 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -66.94 -35.6 80.35 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.535 178.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.445 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 79.4 t60 -58.65 -65.27 0.69 Allowed 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 178.831 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.3 t -61.2 -46.17 97.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.819 178.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.597 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -55.37 -49.85 71.23 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 111.782 0.29 . . . . 0.0 111.782 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.445 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 3.2 p30 -58.58 -29.16 66.21 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.815 0.34 . . . . 0.0 110.709 -179.709 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 41.9 mmt180 -75.14 -28.66 60.24 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.575 179.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.597 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 1.1 mt -69.41 -49.6 53.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.985 0.421 . . . . 0.0 110.529 179.148 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.35 -28.03 66.47 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.168 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.1 ttmm -79.53 -32.73 42.3 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.96 0.41 . . . . 0.0 110.587 179.356 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 5.4 mt . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.782 179.814 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo . . . . . 0 C--O 1.231 0.174 0 CA-C-O 120.378 0.074 . . . . 0.0 111.947 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -139.44 127.7 22.65 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.934 0.397 . . . . 0.0 111.687 -179.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.408 ' N ' ' CD1' ' A' ' 38' ' ' ILE . 3.3 mp -120.86 136.57 57.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.627 179.573 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 23.1 mt -116.91 146.13 21.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.075 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.3 mt -123.26 128.18 49.62 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.759 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 20.1 m -125.21 -172.45 2.59 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.388 179.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.436 ' HG3' ' CE2' ' A' ' 47' ' ' PHE . 0.0 OUTLIER -162.55 145.28 11.05 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.367 0.603 . . . . 0.0 111.249 -179.878 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -133.57 169.89 12.78 Favored Pre-proline 0 C--N 1.322 -0.624 0 CA-C-N 115.052 -0.976 . . . . 0.0 109.322 179.339 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -61.71 -25.81 79.22 Favored 'Trans proline' 0 N--CA 1.464 -0.253 0 C-N-CA 121.91 1.74 . . . . 0.0 112.088 179.633 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -90.45 -8.39 50.65 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.273 -0.876 . . . . 0.0 113.044 -178.895 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 152.47 -169.06 31.62 Favored Glycine 0 C--O 1.225 -0.46 0 C-N-CA 120.065 -1.064 . . . . 0.0 112.515 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.445 ' N ' ' CD1' ' A' ' 47' ' ' PHE . 10.7 m-85 -106.02 153.95 21.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.597 0.713 . . . . 0.0 112.162 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 54.3 t -127.58 141.39 46.5 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 CA-C-N 114.665 -1.152 . . . . 0.0 110.97 -179.322 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.432 ' O ' ' HA ' ' A' ' 63' ' ' SER . . . -133.05 123.2 25.34 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.549 179.642 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -119.56 150.77 39.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.648 0.261 . . . . 0.0 110.854 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -147.44 139.73 24.51 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.75 0.309 . . . . 0.0 111.151 179.589 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 4.5 m -135.14 133.27 39.01 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.328 -0.397 . . . . 0.0 110.171 179.583 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 18.5 mt -134.52 135.6 53.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.039 0.447 . . . . 0.0 111.387 -179.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -104.28 119.66 39.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.458 179.137 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 7.2 p -112.51 167.07 9.73 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.975 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_exo -71.37 -7.84 22.13 Favored 'Trans proline' 0 C--N 1.343 0.279 0 C-N-CA 122.899 2.4 . . . . 0.0 112.636 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -120.19 -4.41 10.0 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 111.776 0.287 . . . . 0.0 111.776 -179.589 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 160.61 -169.76 36.41 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.44 -0.886 . . . . 0.0 112.74 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 15.9 t -130.07 143.3 41.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.781 0.324 . . . . 0.0 111.119 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.4 mt -118.35 151.37 37.86 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.044 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.4 ' O ' ' NE2' ' A' ' 83' ' ' GLN . 21.4 t -140.57 143.55 28.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.887 179.882 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -150.95 151.7 32.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.037 0.446 . . . . 0.0 111.603 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' SER . . . . . 0.432 ' HA ' ' O ' ' A' ' 49' ' ' ALA . 2.0 t -145.09 155.74 43.51 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.722 -179.423 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -149.73 102.07 0.23 Allowed Glycine 0 C--N 1.331 0.279 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.609 179.413 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 5.5 mtmp? -103.84 44.55 1.01 Allowed 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -178.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 12.2 t-80 -75.55 155.64 35.83 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 110.131 -0.322 . . . . 0.0 110.131 178.426 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -60.95 -26.73 67.74 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.731 0.3 . . . . 0.0 111.425 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -97.29 122.17 40.02 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.024 0.44 . . . . 0.0 111.426 -179.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 2.5 ttt -47.98 -51.01 25.47 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.891 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 15.9 m-85 -65.89 -37.6 86.55 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.567 -179.122 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 87.5 m -64.7 -41.16 96.21 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.791 0.329 . . . . 0.0 110.649 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.48 -48.2 82.21 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.439 179.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 15.7 mt -60.3 -45.47 96.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.869 0.366 . . . . 0.0 110.387 179.635 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -64.29 -39.6 94.25 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.5 179.449 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -65.28 -45.07 85.97 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.449 179.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -52.57 -58.2 7.53 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 179.129 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 34.7 mt -57.2 -32.45 40.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 178.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -59.0 -28.61 66.54 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-O 121.148 0.499 . . . . 0.0 110.174 178.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.17 -26.84 24.92 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.118 179.151 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 64.9 mt -62.86 -50.01 72.62 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 107.931 -1.137 . . . . 0.0 107.931 177.424 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -60.87 -44.67 96.75 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 114.598 -1.183 . . . . 0.0 110.571 177.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 1.1 ptt180 -62.85 -37.59 87.46 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.165 -179.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . 0.4 ' NE2' ' O ' ' A' ' 61' ' ' VAL . 35.3 mt-30 -74.28 -40.52 62.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.68 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 3.3 mt -64.79 -24.25 67.49 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.682 179.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 17.8 t-20 -62.47 -27.73 69.33 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.42 179.592 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 8.0 mmtt . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.205 179.985 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.906 0.384 . . . . 0.0 110.841 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -120.78 98.8 6.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.15 -179.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 34.2 mt -102.63 124.16 56.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.643 179.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.8 p -134.25 159.58 40.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.987 0.422 . . . . 0.0 111.097 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 21.5 p -163.86 143.8 8.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.668 -179.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.6 mtmp? -102.51 35.89 2.32 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.035 -179.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -141.11 -47.63 0.4 Allowed 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.777 179.718 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 14.3 mtm -126.22 176.44 7.07 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.691 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -99.79 173.96 6.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.828 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 6.0 mm -91.77 110.76 23.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 121.097 0.475 . . . . 0.0 111.075 -179.677 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 13.2 p -97.52 149.5 35.78 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.146 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_exo -55.84 -20.59 29.51 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.423 2.082 . . . . 0.0 111.746 179.06 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -76.15 -43.92 40.67 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.046 0.45 . . . . 0.0 110.339 179.242 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 32.2 mt -72.34 -27.85 27.37 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.283 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.58 179.118 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 29.4 ttt-85 -77.45 -43.68 31.6 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.714 -0.676 . . . . 0.0 109.531 178.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 34.3 tt0 -67.64 -40.69 84.58 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.638 179.067 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.54 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 79.5 t60 -60.99 -57.32 13.13 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.711 -0.395 . . . . 0.0 109.964 179.167 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 26.9 t -60.35 -47.81 90.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 178.675 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.69 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -59.72 -40.12 86.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.208 -0.451 . . . . 0.0 112.087 179.793 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.54 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 0.9 OUTLIER -59.59 -35.33 74.09 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 120.497 -0.481 . . . . 0.0 109.999 179.918 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -76.42 -27.21 56.18 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.775 179.557 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.69 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 5.3 mt -66.48 -56.03 12.82 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.046 0.45 . . . . 0.0 110.225 179.509 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.26 -21.62 64.08 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.162 179.555 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 6.0 tmtm? -79.24 -29.3 42.63 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.686 179.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.666 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo . . . . . 0 N--CA 1.466 -0.136 0 CA-C-O 120.686 0.203 . . . . 0.0 111.844 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -138.61 126.52 22.42 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.945 0.402 . . . . 0.0 111.521 -179.647 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.406 ' N ' ' CD1' ' A' ' 38' ' ' ILE . 3.4 mp -118.88 135.71 58.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.626 179.521 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 5.3 mt -116.73 147.08 20.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.227 -179.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.3 mt -121.9 127.23 50.21 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.696 179.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -124.1 -172.42 2.54 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.482 179.913 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.422 ' HG3' ' CD2' ' A' ' 47' ' ' PHE . 1.5 ttpt -161.52 139.52 9.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.299 0.571 . . . . 0.0 111.274 -179.686 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -130.81 157.54 77.55 Favored Pre-proline 0 C--N 1.323 -0.553 0 CA-C-N 115.189 -0.914 . . . . 0.0 109.306 179.159 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 70.9 Cg_exo -51.48 -24.63 17.1 Favored 'Trans proline' 0 N--CA 1.464 -0.215 0 C-N-CA 122.012 1.808 . . . . 0.0 112.464 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.5 tt0 -89.2 -6.08 57.18 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.479 -0.782 . . . . 0.0 112.659 -179.14 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 148.86 -160.91 28.56 Favored Glycine 0 C--O 1.224 -0.511 0 C-N-CA 120.289 -0.957 . . . . 0.0 112.224 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.456 ' N ' ' CD1' ' A' ' 47' ' ' PHE . 13.6 m-85 -110.17 154.74 22.91 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.574 0.702 . . . . 0.0 112.096 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 93.7 t -127.22 140.0 50.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 114.691 -1.141 . . . . 0.0 111.036 -179.012 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -131.49 122.19 25.76 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.41 179.402 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -120.3 149.32 42.49 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.691 0.281 . . . . 0.0 111.071 -179.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . 0.42 ' N ' HD13 ' A' ' 76' ' ' LEU . . . -146.55 140.04 25.84 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.815 0.341 . . . . 0.0 111.32 179.535 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.0 m -134.33 131.86 38.83 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.031 179.484 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 21.9 mt -132.25 136.22 56.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 121.043 0.449 . . . . 0.0 111.676 -179.427 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 8.3 m120 -100.97 120.74 40.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.596 179.142 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' THR . . . . . 0.453 ' HB ' ' HD2' ' A' ' 56' ' ' PRO . 5.5 p -113.46 173.4 2.89 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.244 179.862 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . 0.453 ' HD2' ' HB ' ' A' ' 55' ' ' THR . 86.5 Cg_endo -86.98 1.67 7.29 Favored 'Trans proline' 0 N--CA 1.457 -0.642 0 C-N-CA 122.353 2.036 . . . . 0.0 112.632 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 5.0 m120 -131.58 20.95 4.68 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.315 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 139.99 -167.57 25.35 Favored Glycine 0 C--N 1.331 0.265 0 C-N-CA 120.603 -0.808 . . . . 0.0 112.646 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 19.0 t -128.68 144.12 39.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.757 0.313 . . . . 0.0 111.178 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 16.7 mt -118.33 144.4 45.89 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.026 -179.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 21.6 t -140.26 144.69 27.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.147 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -153.37 149.77 28.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.063 0.459 . . . . 0.0 111.419 -179.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 56.0 p -145.08 159.93 42.19 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.866 -179.239 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -150.96 107.33 0.34 Allowed Glycine 0 C--N 1.333 0.371 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.713 179.408 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -105.25 43.99 1.07 Allowed 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.062 0.393 . . . . 0.0 112.062 -178.813 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . 0.412 ' CE1' HG23 ' A' ' 71' ' ' THR . 13.0 t-80 -77.45 155.51 31.71 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.713 0.292 . . . . 0.0 110.561 179.2 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -61.08 -26.91 67.98 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.337 179.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -98.68 118.99 36.65 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.983 0.42 . . . . 0.0 111.401 -179.313 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.8 tmt? -48.01 -45.77 32.21 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.547 179.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 34.4 m-85 -66.52 -41.05 89.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.222 -179.483 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.412 HG23 ' CE1' ' A' ' 66' ' ' HIS . 90.7 m -65.26 -38.28 89.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.877 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.25 -50.82 70.22 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.87 179.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 8.6 mt -62.01 -42.65 95.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.713 0.292 . . . . 0.0 110.275 179.511 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -63.91 -41.89 97.55 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.957 0.408 . . . . 0.0 110.1 179.206 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -65.93 -41.4 91.41 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.506 179.494 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.42 HD13 ' N ' ' A' ' 51' ' ' ALA . 0.3 OUTLIER -53.45 -62.92 1.34 Allowed 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 179.218 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 42.8 mt -54.74 -27.21 18.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 110.227 -0.286 . . . . 0.0 110.227 178.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -58.99 -39.98 83.46 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 178.0 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.1 -30.62 65.27 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 114.844 -1.071 . . . . 0.0 109.944 178.613 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 94.5 mt -63.66 -46.63 84.75 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 107.899 -1.148 . . . . 0.0 107.899 177.575 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 8.2 tt0 -59.98 -51.97 67.41 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 114.894 -1.048 . . . . 0.0 110.628 177.791 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.93 -25.43 68.14 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.384 -179.655 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -74.71 -47.6 30.52 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.837 0.351 . . . . 0.0 110.774 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.1 mt -64.59 -25.37 67.94 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.809 179.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 -63.47 -33.29 75.25 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.923 0.392 . . . . 0.0 110.386 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.342 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.491 179.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.9 ttp . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.892 0.377 . . . . 0.0 110.89 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 43.9 t-20 -127.85 98.87 5.31 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.3 -179.819 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 18.3 pt -105.09 130.0 56.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.459 179.331 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 3.1 p -132.9 169.93 16.06 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.879 0.371 . . . . 0.0 111.052 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.404 ' HB3' ' HB2' ' A' ' 40' ' ' LEU . 25.0 p -162.84 136.71 6.14 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.314 -179.441 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -101.15 37.26 1.8 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.952 -179.781 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -140.82 -48.98 0.43 Allowed 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.592 179.625 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -123.11 174.27 7.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.55 179.78 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.5 pm0 -93.95 165.17 12.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.518 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.5 mm -90.98 114.33 28.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 121.012 0.434 . . . . 0.0 110.983 -179.514 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 11.2 p -99.57 150.0 36.39 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.004 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -56.98 -19.24 31.47 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.318 2.012 . . . . 0.0 111.755 178.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -76.8 -42.77 39.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.092 0.473 . . . . 0.0 110.257 179.27 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 31.9 mt -72.62 -28.59 28.16 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 CA-C-N 115.575 -0.739 . . . . 0.0 109.446 178.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.41 ' O ' ' CB ' ' A' ' 20' ' ' ALA . 53.2 mtp180 -74.82 -45.84 40.7 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.609 178.696 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -67.35 -38.52 84.95 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.616 179.158 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.465 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 77.8 t60 -60.25 -61.74 2.38 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 179.075 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.422 ' O ' ' HG ' ' A' ' 23' ' ' LEU . 18.9 t -60.56 -47.18 93.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 116.618 -0.264 . . . . 0.0 110.676 178.933 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.669 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -58.14 -44.91 88.1 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.354 0.501 . . . . 0.0 112.354 -179.962 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.465 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 0.9 OUTLIER -59.83 -32.84 71.03 Favored 'General case' 0 C--N 1.333 -0.146 0 C-N-CA 120.364 -0.534 . . . . 0.0 110.219 -179.542 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.434 ' HD2' ' OD1' ' A' ' 21' ' ' ASP . 0.0 OUTLIER -73.1 -28.44 62.28 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.652 179.181 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.669 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 5.1 mt -68.44 -53.86 20.8 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.954 0.406 . . . . 0.0 110.599 179.536 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.34 -23.81 62.82 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.233 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -79.22 -33.36 43.77 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 121.206 0.527 . . . . 0.0 110.113 179.346 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 6.1 mt . . . . . 0 C--N 1.327 -0.371 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.047 -179.718 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo . . . . . 0 N--CA 1.462 -0.354 0 CA-C-O 120.703 0.21 . . . . 0.0 112.0 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -138.34 127.95 24.94 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.976 0.417 . . . . 0.0 111.411 -179.617 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 4.9 mp -120.32 137.2 54.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.929 179.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 28.1 mt -119.54 142.21 35.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.172 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.404 ' HB2' ' HB3' ' A' ' 6' ' ' SER . 10.0 mt -120.36 130.15 54.27 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.97 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 14.9 m -125.22 -170.65 2.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.528 179.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.419 ' HG3' ' CD2' ' A' ' 47' ' ' PHE . 3.5 ttpt -158.67 141.41 14.44 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.431 0.634 . . . . 0.0 111.359 -179.7 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -131.32 156.86 79.56 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 115.113 -0.949 . . . . 0.0 109.217 179.143 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_exo -51.82 -24.46 18.54 Favored 'Trans proline' 0 C--O 1.232 0.198 0 C-N-CA 121.942 1.761 . . . . 0.0 112.375 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 34.5 tt0 -89.44 -6.71 56.28 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.501 -0.772 . . . . 0.0 112.778 -179.146 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 149.22 -162.56 29.02 Favored Glycine 0 C--O 1.225 -0.422 0 C-N-CA 120.269 -0.967 . . . . 0.0 112.205 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.419 ' CD2' ' HG3' ' A' ' 42' ' ' LYS . 18.5 m-85 -109.06 152.65 24.74 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.548 0.689 . . . . 0.0 112.026 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 63.8 t -126.51 141.01 47.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 114.829 -1.078 . . . . 0.0 110.912 -179.324 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -132.13 123.78 27.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.753 179.645 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -119.52 149.84 41.24 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.603 0.24 . . . . 0.0 110.855 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -147.3 139.89 24.78 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.72 0.295 . . . . 0.0 111.419 179.615 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.0 m -135.78 129.88 33.19 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.924 -0.399 . . . . 0.0 109.924 179.226 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 8.3 mt -133.03 140.42 47.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-O 121.177 0.513 . . . . 0.0 111.96 -179.326 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 8.6 m120 -100.89 118.72 37.49 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.496 -0.774 . . . . 0.0 110.775 179.212 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 5.9 p -111.05 146.27 34.16 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.153 179.327 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -58.01 -17.52 31.51 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.27 1.98 . . . . 0.0 112.573 -179.451 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -118.67 23.68 11.33 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.581 -0.282 . . . . 0.0 111.572 -179.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 143.99 -165.2 27.38 Favored Glycine 0 C--N 1.331 0.263 0 C-N-CA 120.427 -0.892 . . . . 0.0 113.073 179.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 18.4 t -139.84 142.77 31.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.802 0.334 . . . . 0.0 111.015 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.9 mt -118.64 146.39 44.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.947 0.403 . . . . 0.0 111.299 -179.659 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 21.6 t -139.37 145.3 27.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.807 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -154.03 151.64 29.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.2 0.524 . . . . 0.0 111.648 -179.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' SER . . . . . 0.403 ' HA ' HD12 ' A' ' 76' ' ' LEU . 0.8 OUTLIER -143.13 156.71 44.85 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.416 -0.811 . . . . 0.0 111.575 -179.393 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -151.43 105.86 0.29 Allowed Glycine 0 C--N 1.331 0.305 0 N-CA-C 111.487 -0.645 . . . . 0.0 111.487 179.443 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -107.92 45.06 1.03 Allowed 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 -178.806 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 15.2 t-80 -75.74 156.15 34.89 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.732 0.301 . . . . 0.0 110.353 178.552 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -60.61 -27.48 67.78 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.323 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -97.89 120.73 38.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.031 0.443 . . . . 0.0 111.461 -179.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -48.15 -48.21 34.41 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.724 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 8.2 m-85 -66.4 -41.16 89.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.332 -179.338 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 60.1 m -64.99 -39.49 93.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.798 0.333 . . . . 0.0 110.699 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.72 -50.42 72.49 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.672 179.642 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.404 ' CG1' ' CD2' ' A' ' 40' ' ' LEU . 8.5 mt -60.87 -43.56 95.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.88 0.372 . . . . 0.0 110.324 179.515 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -63.93 -38.87 92.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.091 179.272 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -66.17 -44.77 83.08 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.409 179.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.403 HD12 ' HA ' ' A' ' 63' ' ' SER . 0.3 OUTLIER -51.4 -58.97 4.8 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 179.038 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 43.5 mt -57.36 -29.32 32.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 109.916 -0.402 . . . . 0.0 109.916 178.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -58.84 -30.54 67.75 Favored 'General case' 0 N--CA 1.442 -0.859 0 CA-C-O 121.192 0.52 . . . . 0.0 109.932 178.079 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.5 mptt -84.0 -27.93 28.07 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.387 -0.824 . . . . 0.0 109.834 178.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 89.8 mt -63.74 -49.55 72.6 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 177.493 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -60.26 -50.18 74.67 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 114.862 -1.063 . . . . 0.0 110.501 177.616 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.88 -25.14 68.15 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.098 -179.741 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 8.4 mt-30 -75.33 -45.68 37.97 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.926 0.393 . . . . 0.0 110.42 179.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.1 mt -65.81 -30.98 71.69 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.83 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 47.1 t30 -61.82 -27.75 68.99 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.698 -179.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 2.9 mmtt . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.142 -179.928 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.814 0.34 . . . . 0.0 110.95 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -124.87 130.56 52.61 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.196 -179.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 38.7 mt -132.7 126.84 55.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.833 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -133.63 162.2 32.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.988 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 21.5 p -164.08 136.92 5.1 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.631 -179.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.94 39.26 1.49 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.797 -179.891 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -140.6 -47.81 0.42 Allowed 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.687 179.824 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -133.64 -178.36 4.97 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.898 179.792 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -93.23 164.03 13.39 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.671 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 3.7 mm -90.31 121.05 40.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.886 0.374 . . . . 0.0 110.695 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 17.7 p -101.81 148.21 34.97 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.086 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -56.77 -19.75 32.35 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.413 2.076 . . . . 0.0 111.773 179.203 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -77.61 -40.66 41.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.223 0.535 . . . . 0.0 110.374 179.618 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 26.4 mt -73.09 -31.27 34.4 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.327 178.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.433 ' O ' ' CB ' ' A' ' 20' ' ' ALA . 6.8 mtt85 -72.64 -46.45 53.99 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.512 178.616 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -67.09 -34.81 78.44 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.332 178.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.441 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 78.7 t60 -59.4 -66.02 0.58 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.039 0.447 . . . . 0.0 109.968 178.909 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 15.7 t -61.41 -46.04 97.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.887 179.166 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.631 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -55.56 -48.25 75.07 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 111.601 0.222 . . . . 0.0 111.601 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.441 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 2.7 p30 -59.51 -28.82 67.39 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.885 0.374 . . . . 0.0 110.538 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 18.2 mmt180 -74.75 -29.2 61.07 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.517 179.451 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.631 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 1.1 mt -69.44 -49.65 53.06 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.594 179.185 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.87 -24.96 62.85 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.915 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.45 -37.41 43.65 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.569 179.315 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.6 mt . . . . . 0 C--N 1.328 -0.334 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.81 179.625 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_endo . . . . . 0 N--CA 1.466 -0.126 0 N-CA-C 111.745 -0.137 . . . . 0.0 111.745 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 2.0 t-160 -134.01 132.63 40.33 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.03 0.443 . . . . 0.0 111.521 -179.711 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 24.5 mm -123.19 133.7 68.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.773 179.726 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 37.0 mt -120.63 142.21 37.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.875 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 6.1 mt -121.48 127.41 51.04 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.988 0.423 . . . . 0.0 110.813 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -124.47 -171.35 2.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.602 179.813 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.466 ' HA ' ' HA ' ' A' ' 47' ' ' PHE . 0.0 OUTLIER -172.73 146.33 1.62 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.191 0.52 . . . . 0.0 111.018 -179.758 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.419 ' HB3' ' HD2' ' A' ' 44' ' ' PRO . 30.2 mm-40 -131.9 166.89 25.0 Favored Pre-proline 0 C--N 1.324 -0.527 0 CA-C-N 115.415 -0.811 . . . . 0.0 109.11 179.137 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . 0.419 ' HD2' ' HB3' ' A' ' 43' ' ' GLU . 71.4 Cg_exo -49.35 -20.35 3.69 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 121.764 1.643 . . . . 0.0 112.443 -179.327 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 28.9 tt0 -85.44 -76.89 0.31 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.122 179.156 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . 0.412 ' HA3' ' HA ' ' A' ' 67' ' ' GLU . . . -142.44 -156.79 6.91 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.688 -0.767 . . . . 0.0 112.645 -179.339 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.466 ' HA ' ' HA ' ' A' ' 42' ' ' LYS . 21.4 m-85 -108.17 151.05 26.44 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.607 0.718 . . . . 0.0 112.58 -179.315 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.421 ' HA ' ' HA ' ' A' ' 65' ' ' LYS . 63.5 t -124.61 142.61 40.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 114.543 -1.208 . . . . 0.0 110.537 -179.775 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.428 ' O ' ' HA ' ' A' ' 63' ' ' SER . . . -133.09 125.17 29.0 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.026 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -118.39 145.69 44.98 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.356 179.765 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . 0.445 ' N ' HD12 ' A' ' 76' ' ' LEU . . . -144.69 142.2 29.89 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.798 -0.361 . . . . 0.0 111.602 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 9.2 m -136.14 135.6 39.38 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.582 179.735 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 4.0 mm -132.51 133.63 59.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.709 0.29 . . . . 0.0 110.915 -179.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -108.98 121.81 45.92 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.529 179.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 28.4 p -121.67 164.99 21.49 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.1 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 20.0 Cg_exo -65.9 -11.73 32.18 Favored 'Trans proline' 0 C--N 1.343 0.288 0 C-N-CA 122.785 2.323 . . . . 0.0 112.763 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -111.06 -3.39 15.51 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 111.819 0.303 . . . . 0.0 111.819 -179.601 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 152.39 -167.2 31.34 Favored Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.467 -0.873 . . . . 0.0 112.765 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 17.2 t -131.95 140.65 47.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.73 0.3 . . . . 0.0 111.144 -179.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.7 mt -117.54 153.81 32.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.889 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 13.8 p -140.42 149.62 21.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.307 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -153.99 154.73 34.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.098 0.475 . . . . 0.0 111.411 -179.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' SER . . . . . 0.428 ' HA ' ' O ' ' A' ' 49' ' ' ALA . 0.1 OUTLIER -144.79 157.31 44.22 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.753 -179.315 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -151.87 105.16 0.28 Allowed Glycine 0 C--N 1.331 0.304 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.61 179.4 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.421 ' HA ' ' HA ' ' A' ' 48' ' ' VAL . 8.7 mtpt -107.62 44.73 1.06 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -178.65 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . 0.421 ' CG ' HG23 ' A' ' 71' ' ' THR . 13.9 t-80 -76.18 156.29 33.8 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.877 0.37 . . . . 0.0 110.421 178.522 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.412 ' HA ' ' HA3' ' A' ' 46' ' ' GLY . 1.2 tt0 -60.88 -26.9 67.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.786 0.327 . . . . 0.0 111.119 179.844 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -97.59 123.93 41.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.028 0.442 . . . . 0.0 111.458 -179.292 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 17.1 ttt -48.2 -50.27 29.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.834 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -66.24 -36.74 83.79 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.635 -179.118 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.421 HG23 ' CG ' ' A' ' 66' ' ' HIS . 98.7 m -64.34 -42.28 96.35 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.721 0.296 . . . . 0.0 110.529 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.2 -47.52 85.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.37 179.442 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 14.7 mt -60.35 -47.11 93.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.548 179.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -63.96 -39.14 93.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.596 179.65 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -65.49 -44.97 85.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.469 179.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.445 HD12 ' N ' ' A' ' 51' ' ' ALA . 0.2 OUTLIER -53.01 -57.84 9.0 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 179.194 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 9.3 mt -57.01 -31.97 38.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 178.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -59.11 -30.06 67.83 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-O 121.139 0.495 . . . . 0.0 110.324 178.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 3.8 mptt -84.65 -25.71 28.31 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.217 179.092 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 90.5 mt -62.21 -48.87 78.08 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 107.599 -1.26 . . . . 0.0 107.599 177.111 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -60.22 -44.63 95.03 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 114.362 -1.29 . . . . 0.0 110.549 177.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 85.3 mtt180 -61.59 -31.38 71.43 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.882 -179.703 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 17.0 mt-30 -75.61 -39.78 57.39 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.936 0.398 . . . . 0.0 110.438 179.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 6.5 mt -66.09 -30.33 70.82 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.826 179.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -63.69 -22.64 67.01 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.908 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 5.6 mmtm . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.62 179.974 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.5 tpt . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.811 0.339 . . . . 0.0 110.852 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -124.24 116.49 22.76 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.484 -179.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.413 HD13 HG21 ' A' ' 4' ' ' ILE . 35.2 mt -118.98 125.23 74.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.396 179.389 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -134.35 162.63 31.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.907 0.384 . . . . 0.0 111.313 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.408 ' HB3' ' HB2' ' A' ' 40' ' ' LEU . 21.5 p -162.32 143.25 10.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.35 -179.744 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -102.81 -11.79 18.05 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.626 -179.452 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.03 -25.07 14.43 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 120.757 0.313 . . . . 0.0 111.132 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 1.4 mpp? -137.69 -165.98 1.87 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.871 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 13.6 tt0 -124.02 164.54 19.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.64 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.9 mm -91.2 111.32 23.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 121.075 0.464 . . . . 0.0 111.223 -179.497 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 15.1 p -98.22 152.72 38.13 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.034 179.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -58.5 -18.82 41.23 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.416 2.077 . . . . 0.0 111.757 179.278 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -79.19 -43.19 24.39 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.976 0.417 . . . . 0.0 110.519 179.27 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 30.4 mt -72.26 -28.8 29.95 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.412 178.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 19.5 mtm180 -74.63 -44.98 47.83 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.569 178.797 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 19.0 tt0 -67.69 -39.25 84.44 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.761 179.094 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.551 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 78.2 t60 -60.14 -58.18 9.64 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.623 -0.431 . . . . 0.0 109.881 179.018 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 44.3 t -60.86 -47.54 92.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-O 120.714 0.293 . . . . 0.0 110.258 178.453 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.672 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -58.25 -42.74 87.07 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.204 0.446 . . . . 0.0 112.204 179.77 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.551 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 0.9 OUTLIER -59.2 -35.83 74.3 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 121.007 0.432 . . . . 0.0 110.243 -179.898 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 5.2 mmm180 -76.09 -25.98 56.0 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.581 179.458 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.672 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 3.3 mt -68.31 -56.93 6.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.136 0.493 . . . . 0.0 110.393 179.542 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.08 -25.04 66.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.675 -179.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 7.8 tmtm? -79.11 -41.03 29.58 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.057 0.456 . . . . 0.0 110.506 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 7.0 mt . . . . . 0 C--N 1.327 -0.383 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.688 179.788 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo . . . . . 0 N--CA 1.463 -0.277 0 CA-C-O 120.773 0.239 . . . . 0.0 112.022 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 2.0 t-160 -136.64 127.21 26.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.121 -179.7 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 3.3 mp -119.58 135.24 60.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.92 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 5.5 mt -116.54 142.94 27.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.808 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.408 ' HB2' ' HB3' ' A' ' 6' ' ' SER . 3.7 mm? -116.29 127.47 54.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.068 -179.867 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -123.5 -174.71 3.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.303 179.586 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.426 ' HG3' ' CD2' ' A' ' 47' ' ' PHE . 2.2 ttpp -159.99 139.35 11.05 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.282 0.563 . . . . 0.0 111.303 -179.731 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -130.9 156.07 80.56 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-N 115.091 -0.958 . . . . 0.0 109.241 179.161 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_exo -51.34 -24.39 15.77 Favored 'Trans proline' 0 N--CA 1.465 -0.186 0 C-N-CA 121.936 1.757 . . . . 0.0 112.464 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.31 -6.56 56.61 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.439 -0.8 . . . . 0.0 112.654 -179.177 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 149.82 -162.42 29.13 Favored Glycine 0 C--O 1.224 -0.483 0 C-N-CA 120.248 -0.977 . . . . 0.0 112.222 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.426 ' CD2' ' HG3' ' A' ' 42' ' ' LYS . 17.9 m-85 -110.01 154.55 23.02 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.425 0.631 . . . . 0.0 111.986 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 55.4 t -129.19 139.04 52.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 114.966 -1.015 . . . . 0.0 111.064 -179.297 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -129.82 123.34 30.67 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.265 179.47 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -119.08 149.67 41.29 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.718 0.294 . . . . 0.0 111.051 -179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . 0.43 ' N ' HD12 ' A' ' 76' ' ' LEU . . . -145.85 140.16 26.86 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.437 179.746 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.1 m -134.86 130.72 36.43 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.018 179.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 6.7 mt -132.69 137.3 54.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 121.047 0.451 . . . . 0.0 111.68 -179.478 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -102.28 134.96 44.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.796 179.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 6.0 p -129.88 160.55 64.46 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.418 179.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_exo -67.59 -10.51 28.97 Favored 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.461 2.108 . . . . 0.0 112.687 -179.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -115.79 -3.94 12.18 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 111.801 0.297 . . . . 0.0 111.801 -179.697 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 159.25 -167.12 34.91 Favored Glycine 0 C--N 1.331 0.282 0 C-N-CA 120.391 -0.909 . . . . 0.0 112.82 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 15.4 t -131.64 140.89 47.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 120.802 0.334 . . . . 0.0 111.163 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.5 mp -116.47 151.6 35.75 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.045 -179.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 14.1 p -139.96 149.05 22.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.147 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -154.93 150.2 27.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.302 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' SER . . . . . 0.442 ' HA ' HD11 ' A' ' 76' ' ' LEU . 0.9 OUTLIER -145.8 156.49 43.62 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.783 -179.402 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -150.04 104.6 0.28 Allowed Glycine 0 CA--C 1.519 0.335 0 N-CA-C 111.37 -0.692 . . . . 0.0 111.37 179.287 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 6.0 mtmt -106.93 45.11 1.0 Allowed 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -178.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 12.3 t-80 -75.72 156.91 34.23 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 178.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.4 pm0 -60.17 -27.24 66.95 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.759 0.314 . . . . 0.0 111.263 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -98.63 118.43 35.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.975 0.417 . . . . 0.0 111.301 -179.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 11.5 ttt -47.43 -45.04 25.3 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.559 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 8.5 m-85 -66.7 -39.67 88.17 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.072 -179.716 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 93.2 m -65.41 -38.79 91.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.73 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.62 -50.8 71.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.758 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 6.8 mt -62.08 -41.18 90.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-O 120.741 0.305 . . . . 0.0 110.243 179.355 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -64.06 -41.72 97.26 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.923 0.392 . . . . 0.0 110.047 179.096 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 62.0 mt-10 -67.26 -41.08 86.17 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.829 179.502 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.442 HD11 ' HA ' ' A' ' 63' ' ' SER . 0.4 OUTLIER -54.64 -64.78 0.72 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.326 179.662 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 55.5 mt -55.85 -26.79 21.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.567 -0.288 . . . . 0.0 110.272 178.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -58.53 -39.62 80.66 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 178.066 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.16 -30.86 63.88 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.834 -1.076 . . . . 0.0 110.287 178.754 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.4 ' O ' ' HB2' ' A' ' 83' ' ' GLN . 90.3 mt -61.66 -45.2 95.06 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 107.61 -1.256 . . . . 0.0 107.61 177.451 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -57.33 -52.57 64.83 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 114.807 -1.088 . . . . 0.0 110.287 177.332 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 39.7 mtt180 -65.18 -16.55 63.64 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.566 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . 0.4 ' HB2' ' O ' ' A' ' 80' ' ' LEU . 8.2 mt-30 -75.44 -55.3 5.83 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.564 0.221 . . . . 0.0 111.067 -179.826 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.5 mp -64.12 -27.68 69.25 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.089 0.471 . . . . 0.0 110.456 179.62 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -61.92 -36.27 80.87 Favored 'General case' 0 CA--C 1.521 -0.157 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.352 -179.27 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 8.4 mmtm . . . . . 0 C--N 1.327 -0.389 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.11 -179.757 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' MET . . . . . 0.425 ' CG ' ' CD1' ' A' ' 23' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.79 0.328 . . . . 0.0 110.944 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 39.4 t-20 -113.56 142.17 46.29 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.485 -179.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.404 HD11 HG23 ' A' ' 4' ' ' ILE . 21.2 mt -131.37 123.84 53.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.597 179.499 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.8 p -134.92 157.5 46.7 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.947 0.403 . . . . 0.0 111.31 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 21.7 p -163.32 143.32 8.82 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.508 -179.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.4 mtmt -101.05 12.56 37.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.294 -179.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -142.43 25.87 1.83 Allowed 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.801 179.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 2.4 mtm 179.37 172.51 0.89 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.859 -179.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 14.0 pm0 -114.9 168.41 9.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.477 179.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 6.5 mm -89.94 107.99 18.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 121.061 0.457 . . . . 0.0 111.349 -179.263 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 14.1 p -97.28 150.98 37.4 Favored Pre-proline 0 C--N 1.327 -0.389 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.831 179.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_endo -56.08 -26.8 61.57 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.475 2.117 . . . . 0.0 111.66 179.069 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -71.43 -44.6 64.54 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.634 179.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 34.7 mt -72.19 -27.92 27.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 178.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 63.1 mtm180 -76.39 -44.63 35.3 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.776 178.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -67.75 -40.37 84.1 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.686 179.14 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.524 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 78.1 t60 -60.57 -58.0 10.35 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 179.07 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.402 ' O ' ' HG ' ' A' ' 23' ' ' LEU . 22.0 t -60.01 -47.49 91.59 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.447 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 178.554 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.706 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -59.4 -39.66 84.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.934 179.654 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.524 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 0.9 OUTLIER -59.64 -34.75 73.2 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 121.134 0.492 . . . . 0.0 109.924 179.915 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 36.5 mmt180 -75.55 -25.4 57.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.713 179.35 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.706 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 14.8 mt -66.98 -55.82 12.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.104 0.478 . . . . 0.0 110.083 179.199 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.57 -21.92 63.12 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.135 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -78.91 -30.58 44.92 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.119 0.485 . . . . 0.0 110.312 179.375 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.561 179.691 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo . . . . . 0 N--CA 1.461 -0.401 0 N-CA-C 110.966 -0.436 . . . . 0.0 110.966 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 1.4 t-160 -134.49 128.91 34.34 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.104 0.478 . . . . 0.0 112.155 -178.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 4.9 mp -119.49 133.52 66.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.152 179.189 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 38.4 mt -116.43 154.39 18.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.908 0.385 . . . . 0.0 111.51 -179.51 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -127.28 126.01 41.89 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.711 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 3.2 m -123.18 -176.67 3.48 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.655 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.481 ' HG3' ' CE2' ' A' ' 47' ' ' PHE . 0.1 OUTLIER -158.42 138.1 11.97 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.324 0.583 . . . . 0.0 111.26 -179.63 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -130.74 155.49 81.25 Favored Pre-proline 0 C--N 1.322 -0.614 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.393 179.285 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -51.16 -24.69 15.41 Favored 'Trans proline' 0 C--O 1.232 0.221 0 C-N-CA 122.013 1.809 . . . . 0.0 112.372 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.41 -6.5 56.51 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.582 -0.736 . . . . 0.0 112.612 -179.15 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 150.12 -162.58 29.25 Favored Glycine 0 C--O 1.224 -0.477 0 C-N-CA 120.245 -0.978 . . . . 0.0 112.3 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.481 ' CE2' ' HG3' ' A' ' 42' ' ' LYS . 11.3 m-85 -109.92 155.25 21.98 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.435 0.636 . . . . 0.0 111.927 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 49.1 t -129.2 139.09 52.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 114.945 -1.025 . . . . 0.0 111.205 -179.198 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -130.49 122.94 28.58 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.444 179.44 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -119.64 149.77 41.43 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.828 0.347 . . . . 0.0 111.017 -179.672 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . 0.41 ' N ' HD12 ' A' ' 76' ' ' LEU . . . -145.28 139.39 27.06 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.166 179.567 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.0 m -135.43 130.94 35.58 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.251 179.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 16.1 mt -132.72 135.27 57.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 120.912 0.387 . . . . 0.0 111.412 -179.653 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -103.13 134.49 46.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.442 179.365 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' THR . . . . . 0.415 ' HB ' ' HD2' ' A' ' 56' ' ' PRO . 58.1 p -133.07 157.44 78.31 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.561 179.809 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . 0.415 ' HD2' ' HB ' ' A' ' 55' ' ' THR . 43.1 Cg_endo -68.31 -7.34 19.82 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.302 2.001 . . . . 0.0 112.716 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 88.5 m-20 -124.14 22.93 8.58 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.591 0.234 . . . . 0.0 111.604 -179.803 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 138.69 -165.51 25.55 Favored Glycine 0 C--N 1.331 0.294 0 C-N-CA 120.406 -0.902 . . . . 0.0 112.964 179.728 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 21.4 t -142.4 144.53 24.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.766 0.317 . . . . 0.0 111.122 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 8.4 mp -118.7 142.82 47.31 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.306 -179.667 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 21.4 t -140.81 142.33 30.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.907 179.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -153.51 154.39 34.24 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.257 0.551 . . . . 0.0 111.609 -179.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 80.3 p -145.09 159.55 42.79 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.828 -179.263 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -152.61 102.8 0.23 Allowed Glycine 0 C--N 1.331 0.305 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.47 179.466 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.42 44.33 1.05 Allowed 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -178.771 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 12.5 t-80 -75.23 156.28 35.92 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.589 -0.278 . . . . 0.0 110.253 178.57 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -60.2 -27.25 67.01 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.727 0.299 . . . . 0.0 111.364 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 32.5 t0 -97.66 116.53 30.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.931 0.396 . . . . 0.0 111.191 -179.375 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.4 ttt -46.92 -44.06 19.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.414 179.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -66.81 -42.38 85.98 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.886 -179.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 71.5 m -65.75 -37.51 86.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.917 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.96 -52.93 62.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.958 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 6.3 mt -61.6 -41.32 89.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.827 0.346 . . . . 0.0 110.235 179.505 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -63.7 -40.0 95.72 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.267 -0.424 . . . . 0.0 109.929 179.068 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -66.35 -41.6 89.3 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.478 179.293 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.41 HD12 ' N ' ' A' ' 51' ' ' ALA . 0.2 OUTLIER -52.74 -62.32 1.72 Allowed 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 179.042 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 4.9 mt -55.9 -29.14 25.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 178.507 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -59.26 -30.51 68.34 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-O 121.112 0.482 . . . . 0.0 110.14 178.27 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.408 ' HA ' ' CE ' ' A' ' 79' ' ' LYS . 0.1 OUTLIER -86.9 -28.02 23.05 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.446 179.069 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 92.5 mt -63.73 -48.82 75.51 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.048 -1.094 . . . . 0.0 108.048 177.596 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -60.21 -49.87 75.9 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 114.984 -1.007 . . . . 0.0 110.462 177.741 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 3.6 mtt180 -63.92 -25.51 68.18 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.476 -179.535 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 23.7 mt-30 -73.87 -45.93 47.95 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.811 0.339 . . . . 0.0 110.703 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -64.84 -28.61 69.67 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.799 179.835 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -62.38 -28.64 69.92 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.003 0.43 . . . . 0.0 110.308 179.619 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.331 -0.233 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.394 179.628 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.836 0.351 . . . . 0.0 110.854 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -125.31 134.61 52.18 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.236 -179.708 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 9.0 tt -135.09 125.94 45.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.349 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 3.0 p -134.76 165.33 25.53 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.901 0.381 . . . . 0.0 111.446 -179.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 3.2 p -161.59 130.42 4.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.978 -0.556 . . . . 0.0 109.991 -179.388 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 15.0 mtmt -99.0 13.67 31.92 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.271 -179.601 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 11.2 tp60 -141.91 21.67 2.12 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.636 179.319 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 176.74 161.96 0.41 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.51 -179.754 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -96.62 160.28 14.47 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.21 179.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.404 HD12 HG22 ' A' ' 11' ' ' ILE . 3.9 mm -90.27 119.3 37.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.002 0.429 . . . . 0.0 111.202 -179.372 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 16.8 p -100.58 157.27 34.05 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.641 179.434 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_exo -61.01 -15.08 36.74 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.477 2.118 . . . . 0.0 112.233 179.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -88.7 -38.72 14.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.904 0.383 . . . . 0.0 110.725 179.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 18.2 mt -73.57 -31.75 33.62 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 N-CA-C 109.484 -0.562 . . . . 0.0 109.484 179.028 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.412 ' O ' ' CB ' ' A' ' 20' ' ' ALA . 0.4 OUTLIER -72.55 -46.62 53.62 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.273 178.749 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -67.04 -33.64 75.97 Favored 'General case' 0 N--CA 1.456 -0.171 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.189 178.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.426 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 77.6 t60 -58.85 -66.22 0.54 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.995 0.426 . . . . 0.0 109.854 178.659 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 12.2 t -61.39 -44.61 98.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.796 178.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.586 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -55.15 -50.13 70.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.56 179.703 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.426 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 3.1 p30 -59.02 -28.57 66.54 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-O 120.894 0.378 . . . . 0.0 110.567 -179.938 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 13.8 mmt180 -74.09 -28.84 61.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.447 179.349 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.586 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 1.1 mt -69.7 -47.35 63.5 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.304 179.086 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.99 -27.35 66.79 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.962 179.617 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -79.34 -31.91 43.17 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.775 179.539 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 10.1 mt . . . . . 0 C--N 1.328 -0.358 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.863 179.817 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo . . . . . 0 C--O 1.232 0.19 0 N-CA-C 111.854 -0.095 . . . . 0.0 111.854 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 19.5 t-160 -134.42 133.73 40.84 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.711 -0.396 . . . . 0.0 111.411 -179.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.431 ' N ' ' CD1' ' A' ' 38' ' ' ILE . 2.7 mp -126.17 131.09 71.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.666 179.619 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 25.1 mt -121.31 138.93 50.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.71 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 10.0 mt -121.31 127.96 51.84 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.949 0.404 . . . . 0.0 110.811 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 8.5 m -125.59 -170.57 2.2 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.751 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.441 ' HA ' ' HA ' ' A' ' 47' ' ' PHE . 3.9 tttt -171.85 146.78 2.11 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.113 0.483 . . . . 0.0 110.794 -179.879 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.426 ' N ' ' HG2' ' A' ' 42' ' ' LYS . 7.2 mt-10 -131.45 169.57 13.45 Favored Pre-proline 0 C--N 1.324 -0.536 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.06 178.966 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_exo -51.61 -19.96 8.32 Favored 'Trans proline' 0 N--CA 1.463 -0.307 0 C-N-CA 121.776 1.65 . . . . 0.0 112.23 -179.416 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -85.73 -76.71 0.32 Allowed 'General case' 0 N--CA 1.445 -0.708 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.309 179.379 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . 0.418 ' HA3' ' HA ' ' A' ' 67' ' ' GLU . . . -142.99 -156.75 6.88 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.766 -179.336 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.441 ' HA ' ' HA ' ' A' ' 42' ' ' LYS . 22.3 m-85 -108.06 150.61 26.95 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-O 121.65 0.738 . . . . 0.0 112.57 -179.302 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.415 ' HA ' ' HA ' ' A' ' 65' ' ' LYS . 62.2 t -124.78 140.76 47.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 114.477 -1.238 . . . . 0.0 110.405 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -132.19 124.41 28.96 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.672 -0.24 . . . . 0.0 110.715 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -120.65 147.04 45.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.62 -0.264 . . . . 0.0 110.67 -179.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . 0.404 ' N ' HD13 ' A' ' 76' ' ' LEU . . . -145.39 142.03 28.98 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.899 0.381 . . . . 0.0 111.433 179.738 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.9 m -136.02 131.67 35.28 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.101 -0.5 . . . . 0.0 109.99 179.419 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 22.0 mt -132.85 137.52 53.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 121.0 0.429 . . . . 0.0 111.344 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -105.02 128.77 53.46 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.184 179.092 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' THR . . . . . 0.574 ' HB ' ' HD2' ' A' ' 56' ' ' PRO . 5.7 p -124.82 166.35 20.63 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.361 -179.895 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . 0.574 ' HD2' ' HB ' ' A' ' 55' ' ' THR . 56.7 Cg_endo -72.79 -4.08 14.72 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.228 1.952 . . . . 0.0 112.529 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 81.1 m-20 -117.98 -4.3 11.08 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.406 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 154.1 -171.93 32.72 Favored Glycine 0 C--N 1.332 0.333 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.699 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 21.4 t -127.33 142.69 42.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.739 0.304 . . . . 0.0 111.093 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 30.1 mt -119.37 152.36 36.93 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.323 -0.398 . . . . 0.0 111.315 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.42 ' O ' ' NE2' ' A' ' 83' ' ' GLN . 21.6 t -141.56 143.61 27.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.815 179.735 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -151.0 156.9 42.11 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.13 0.491 . . . . 0.0 111.545 -179.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 10.6 m -145.16 154.78 42.79 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.718 -179.326 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -148.91 100.78 0.21 Allowed Glycine 0 C--N 1.332 0.357 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.699 179.4 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.415 ' HA ' ' HA ' ' A' ' 48' ' ' VAL . 8.8 mttt -102.52 44.57 1.0 Allowed 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -178.838 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 12.1 t-80 -76.36 155.3 34.23 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.78 0.324 . . . . 0.0 110.311 178.536 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.418 ' HA ' ' HA3' ' A' ' 46' ' ' GLY . 26.0 mt-10 -62.06 -26.22 68.14 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.759 0.314 . . . . 0.0 111.339 -179.871 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -97.28 121.95 39.76 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.044 0.449 . . . . 0.0 111.358 -179.395 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.6 ttt -47.51 -51.37 20.81 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.998 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 36.3 m-85 -65.91 -36.77 84.3 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.729 -179.023 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 94.2 m -64.23 -42.23 96.65 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.824 0.345 . . . . 0.0 110.658 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.51 -47.22 86.61 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.429 179.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 28.8 mt -59.71 -48.74 86.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.77 179.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 19.6 m-20 -64.03 -38.54 91.43 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.74 179.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -65.37 -45.66 83.22 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.606 179.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.404 HD13 ' N ' ' A' ' 51' ' ' ALA . 0.3 OUTLIER -54.22 -56.28 19.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.541 -0.3 . . . . 0.0 110.418 179.425 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 52.3 mt -57.86 -33.21 45.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 N-CA-C 110.227 -0.286 . . . . 0.0 110.227 179.231 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -58.63 -35.52 72.64 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.545 0.688 . . . . 0.0 109.781 178.641 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.4 mptp? -76.81 -27.77 55.31 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 114.83 -1.077 . . . . 0.0 110.138 179.409 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 96.3 mt -62.05 -50.14 73.19 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 177.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -62.79 -46.25 88.86 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 114.277 -1.329 . . . . 0.0 110.709 177.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.69 -34.14 75.23 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.07 -179.588 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . 0.42 ' NE2' ' O ' ' A' ' 61' ' ' VAL . 36.9 mt-30 -75.39 -36.08 60.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.586 179.713 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 4.3 mt -64.66 -27.68 69.09 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.83 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -64.17 -26.02 68.34 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.729 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.307 0 CA-C-O 121.215 0.531 . . . . 0.0 110.85 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 5.9 tmm? . . . . . 0 C--O 1.231 0.084 0 CA-C-O 120.778 0.323 . . . . 0.0 110.827 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -124.0 107.15 11.0 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.369 -179.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 40.0 mt -109.09 126.14 66.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.619 179.546 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -133.99 162.01 33.23 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.922 0.391 . . . . 0.0 111.147 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 21.6 p -162.72 137.58 6.69 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.298 -179.586 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.4 mmtt -101.82 34.65 2.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.116 -179.569 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -141.96 -45.3 0.34 Allowed 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.942 179.711 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.41 -177.81 4.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.84 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -106.8 163.95 12.51 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.435 179.817 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 3.8 mm -90.32 118.07 34.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 121.037 0.446 . . . . 0.0 111.009 -179.557 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 16.1 p -100.84 153.99 37.42 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.854 179.648 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_endo -57.37 -27.33 75.15 Favored 'Trans proline' 0 C--N 1.343 0.289 0 C-N-CA 122.417 2.078 . . . . 0.0 111.904 179.306 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -74.82 -40.41 61.08 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.934 0.397 . . . . 0.0 110.518 179.665 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 26.0 mt -73.14 -31.05 33.28 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 178.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.92 -46.24 58.36 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.399 178.73 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -67.61 -35.15 78.4 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.306 178.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.457 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 52.6 t60 -58.29 -63.56 1.22 Allowed 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 178.671 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 28.6 t -61.41 -42.9 95.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.528 -0.305 . . . . 0.0 110.258 178.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.641 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -56.62 -46.13 81.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.46 179.401 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.457 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 1.2 p30 -60.02 -31.88 70.36 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 120.923 0.392 . . . . 0.0 110.546 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 36.1 mmt180 -73.23 -27.11 61.41 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.613 179.66 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.641 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 2.0 mt -68.78 -49.82 55.47 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.118 0.485 . . . . 0.0 109.994 178.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.21 -26.42 66.36 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.016 179.459 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 19.8 tttt -77.22 -32.74 56.1 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.726 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 5.1 mt . . . . . 0 C--N 1.327 -0.371 0 CA-C-O 120.845 0.355 . . . . 0.0 110.623 179.234 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo . . . . . 0 N--CA 1.463 -0.268 0 CA-C-O 120.528 0.137 . . . . 0.0 112.279 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -133.95 133.71 41.7 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 121.053 -0.259 . . . . 0.0 110.492 179.634 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.419 ' N ' ' CD1' ' A' ' 38' ' ' ILE . 3.1 mp -129.43 129.52 67.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.895 0.379 . . . . 0.0 111.155 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 3.9 mp -118.09 140.47 41.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.404 179.511 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -117.91 126.66 52.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.951 0.405 . . . . 0.0 111.161 -179.636 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -123.68 -172.88 2.62 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.379 179.638 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.456 ' CE ' ' CE2' ' A' ' 47' ' ' PHE . 13.4 tttm -172.95 146.73 1.56 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.197 0.522 . . . . 0.0 111.003 -179.803 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.406 ' HB3' ' HD2' ' A' ' 44' ' ' PRO . 43.7 mt-10 -132.33 166.79 26.12 Favored Pre-proline 0 C--N 1.323 -0.583 0 CA-C-N 115.428 -0.805 . . . . 0.0 109.153 179.054 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . 0.406 ' HD2' ' HB3' ' A' ' 43' ' ' GLU . 73.7 Cg_exo -50.05 -19.75 4.45 Favored 'Trans proline' 0 N--CA 1.464 -0.236 0 C-N-CA 121.678 1.586 . . . . 0.0 112.365 -179.529 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.75 -76.25 0.34 Allowed 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 115.575 -0.738 . . . . 0.0 110.328 179.317 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . 0.423 ' HA3' ' HA ' ' A' ' 67' ' ' GLU . . . -142.72 -158.74 7.66 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.751 -179.301 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.456 ' CE2' ' CE ' ' A' ' 42' ' ' LYS . 24.2 m-85 -107.35 151.19 25.83 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 121.577 0.703 . . . . 0.0 112.433 -179.298 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.441 ' HA ' ' HA ' ' A' ' 65' ' ' LYS . 78.7 t -126.0 139.78 50.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 114.712 -1.131 . . . . 0.0 110.577 -179.881 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.431 ' O ' ' HA ' ' A' ' 63' ' ' SER . . . -131.03 124.44 30.88 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.642 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -120.07 148.66 43.31 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.694 0.283 . . . . 0.0 110.737 -179.969 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . 0.426 ' N ' HD13 ' A' ' 76' ' ' LEU . . . -145.11 142.08 29.36 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.976 0.417 . . . . 0.0 111.399 179.925 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 4.0 m -133.84 132.03 39.92 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.78 179.466 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 13.2 mt -133.81 136.78 53.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.996 0.426 . . . . 0.0 111.516 -179.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -100.83 144.32 29.93 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.54 179.011 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 24.4 p -136.3 168.68 16.08 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.735 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_exo -71.84 -12.98 29.15 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.843 2.362 . . . . 0.0 112.705 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -130.15 21.36 5.3 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 112.038 0.384 . . . . 0.0 112.038 -179.368 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 150.52 -164.79 29.9 Favored Glycine 0 C--N 1.33 0.223 0 C-N-CA 120.082 -1.056 . . . . 0.0 113.334 179.682 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 12.8 t -141.7 146.55 22.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.687 0.279 . . . . 0.0 110.921 -179.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.8 mt -119.11 147.44 44.16 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.871 0.367 . . . . 0.0 111.271 -179.679 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 9.2 p -141.18 147.37 22.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.018 179.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -155.23 154.41 32.15 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.078 0.466 . . . . 0.0 111.333 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' SER . . . . . 0.431 ' HA ' ' O ' ' A' ' 49' ' ' ALA . 3.1 p -146.56 153.99 41.0 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.737 -179.41 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -147.47 107.03 0.37 Allowed Glycine 0 C--N 1.333 0.386 0 N-CA-C 111.496 -0.642 . . . . 0.0 111.496 179.199 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.441 ' HA ' ' HA ' ' A' ' 48' ' ' VAL . 13.6 mtpt -107.24 44.75 1.04 Allowed 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 -178.701 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . 0.462 ' CG ' ' CG2' ' A' ' 71' ' ' THR . 12.8 t-80 -76.77 155.65 32.97 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.81 0.338 . . . . 0.0 110.292 178.688 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.423 ' HA ' ' HA3' ' A' ' 46' ' ' GLY . 1.3 mm-40 -61.64 -26.29 67.91 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.823 0.344 . . . . 0.0 111.185 179.819 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -98.09 123.69 42.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.367 -179.558 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 6.1 ttt -47.63 -47.43 29.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.773 -0.648 . . . . 0.0 111.796 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -66.46 -38.71 87.95 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.861 -179.016 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.462 ' CG2' ' CG ' ' A' ' 66' ' ' HIS . 87.8 m -63.84 -42.01 97.69 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.707 0.289 . . . . 0.0 110.76 -179.749 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.64 -49.0 78.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.541 179.678 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 23.1 mt -59.91 -47.54 91.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.788 179.715 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -63.39 -37.74 88.44 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.604 179.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -65.64 -44.1 87.46 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.575 179.57 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.426 HD13 ' N ' ' A' ' 51' ' ' ALA . 0.3 OUTLIER -54.49 -56.8 15.1 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.269 179.323 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 14.1 mm -57.66 -30.31 36.78 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.493 -0.322 . . . . 0.0 110.133 179.044 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -58.32 -36.32 73.2 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.474 0.654 . . . . 0.0 109.694 178.534 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 5.7 mmtm -76.29 -30.06 57.61 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.853 -1.067 . . . . 0.0 110.375 179.365 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 31.4 mt -60.33 -49.68 76.62 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 177.477 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -61.44 -43.16 99.36 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 114.207 -1.361 . . . . 0.0 110.091 177.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.42 -30.6 71.34 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.55 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -76.35 -40.21 51.85 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.015 0.436 . . . . 0.0 110.48 179.486 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 6.5 mt -64.98 -30.76 71.77 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.646 179.684 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 -64.3 -52.66 57.45 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.551 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 6.9 mmtm . . . . . 0 C--N 1.328 -0.334 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.48 179.52 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 8.4 tmm? . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.899 0.381 . . . . 0.0 110.886 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -103.0 124.87 49.33 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.19 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 34.5 mt -109.89 124.01 66.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.873 179.786 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.8 p -134.09 156.7 47.81 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.059 179.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 22.0 p -164.37 139.79 5.89 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.614 -179.754 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 6.2 mtmp? -101.55 35.5 2.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.809 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -141.94 -50.23 0.39 Allowed 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.755 179.823 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 17.5 mtm -119.01 177.9 4.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.857 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 -104.52 164.96 11.38 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.736 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.8 mm -90.02 112.35 24.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 121.088 0.471 . . . . 0.0 111.009 -179.678 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 19.3 p -98.92 148.69 34.91 Favored Pre-proline 0 C--N 1.326 -0.419 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.018 179.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_exo -55.3 -21.06 27.53 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.325 2.017 . . . . 0.0 111.69 179.148 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -76.12 -42.81 45.82 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.051 0.453 . . . . 0.0 110.317 179.255 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 24.6 mt -72.41 -29.02 29.92 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.34 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.489 178.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 79.4 mtt180 -74.67 -45.19 46.19 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.575 -0.739 . . . . 0.0 109.74 178.773 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 3.3 tm0? -67.38 -38.89 85.44 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.564 179.022 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.497 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 78.3 t60 -59.75 -60.58 3.61 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 178.975 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.427 ' O ' ' HG ' ' A' ' 23' ' ' LEU . 15.1 t -60.45 -46.94 94.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 C-N-CA 121.014 -0.274 . . . . 0.0 110.31 178.733 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.685 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -58.1 -41.58 83.81 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.887 179.7 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.497 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 0.9 OUTLIER -59.59 -34.37 72.64 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.006 0.431 . . . . 0.0 110.064 179.9 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 9.0 mmt180 -74.81 -25.98 59.41 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.747 179.551 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.685 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 10.1 mt -68.85 -57.41 5.59 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.285 0.564 . . . . 0.0 110.521 179.388 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.15 -25.76 65.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.291 -0.868 . . . . 0.0 111.566 -179.777 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 10.1 tppt? -78.64 -32.57 47.37 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.039 0.447 . . . . 0.0 110.29 179.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 44.4 mt . . . . . 0 C--N 1.327 -0.379 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.836 -179.957 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo . . . . . 0 N--CA 1.465 -0.161 0 CA-C-O 120.72 0.217 . . . . 0.0 111.896 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 1.5 t-160 -137.36 131.11 31.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.043 0.449 . . . . 0.0 111.369 -179.596 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.402 ' CD1' ' CB ' ' A' ' 51' ' ' ALA . 8.5 mm -121.0 134.31 64.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.703 179.766 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 23.3 mt -120.85 142.27 37.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.026 -179.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 10.3 mt -121.29 128.31 52.21 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.78 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.3 m -124.65 -171.53 2.37 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.492 179.813 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.416 ' HG3' ' CD2' ' A' ' 47' ' ' PHE . 7.5 ttpp -160.41 141.18 11.88 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.339 0.59 . . . . 0.0 111.353 -179.739 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -131.49 157.47 78.04 Favored Pre-proline 0 C--N 1.322 -0.593 0 CA-C-N 115.089 -0.959 . . . . 0.0 109.27 179.25 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_exo -52.41 -24.49 21.8 Favored 'Trans proline' 0 N--CA 1.464 -0.235 0 C-N-CA 121.808 1.672 . . . . 0.0 112.371 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -89.48 -6.83 56.1 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.433 -0.803 . . . . 0.0 112.766 -179.081 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 150.12 -163.87 29.55 Favored Glycine 0 C--O 1.224 -0.493 0 C-N-CA 120.239 -0.982 . . . . 0.0 112.16 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.416 ' CD2' ' HG3' ' A' ' 42' ' ' LYS . 18.7 m-85 -109.19 154.02 22.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.529 0.68 . . . . 0.0 111.959 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 74.6 t -127.72 139.73 51.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 114.858 -1.065 . . . . 0.0 111.042 -179.204 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -130.94 122.83 27.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.38 179.481 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -118.64 149.48 41.32 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.709 0.29 . . . . 0.0 110.807 -179.813 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . 0.402 ' CB ' ' CD1' ' A' ' 38' ' ' ILE . . . -144.31 139.38 28.52 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.234 179.787 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.7 m -133.78 131.44 39.33 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 179.393 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 19.0 mt -133.05 136.6 55.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 121.146 0.498 . . . . 0.0 111.729 -179.226 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -101.79 119.06 38.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.688 179.38 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 9.3 p -112.46 155.89 43.06 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.529 179.717 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -63.01 -14.08 39.24 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.521 2.148 . . . . 0.0 112.576 -179.806 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 61.8 m-80 -120.38 22.23 11.38 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 111.709 0.262 . . . . 0.0 111.709 -179.605 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 139.33 -167.14 25.32 Favored Glycine 0 N--CA 1.453 -0.212 0 C-N-CA 120.446 -0.883 . . . . 0.0 112.85 179.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 16.6 t -137.59 142.33 36.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.82 0.343 . . . . 0.0 111.04 -179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.6 mp -116.34 153.54 31.81 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.104 -179.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 21.6 t -140.26 147.15 23.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.067 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -153.77 151.69 29.86 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.023 0.439 . . . . 0.0 111.576 -179.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -145.18 155.24 43.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.664 -179.342 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -148.67 104.53 0.28 Allowed Glycine 0 C--N 1.333 0.367 0 N-CA-C 111.399 -0.681 . . . . 0.0 111.399 179.32 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 10.7 mttm -106.87 45.5 0.98 Allowed 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -178.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . 0.416 ' CG ' HG22 ' A' ' 71' ' ' THR . 14.6 t-80 -75.47 156.26 35.4 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 178.474 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -59.97 -27.56 66.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.752 0.311 . . . . 0.0 111.218 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -97.97 119.89 37.41 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.985 0.421 . . . . 0.0 111.475 -179.343 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.2 ttt -47.73 -46.27 29.71 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.502 179.732 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 45.6 m-85 -66.57 -39.51 88.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.127 -179.556 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.416 HG22 ' CG ' ' A' ' 66' ' ' HIS . 92.4 m -65.42 -38.56 90.27 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.668 179.87 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.03 -50.64 71.23 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.825 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 7.3 mt -61.34 -42.01 92.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.698 0.285 . . . . 0.0 110.249 179.518 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -64.53 -40.74 96.17 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.13 0.491 . . . . 0.0 109.965 178.862 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -65.41 -44.58 87.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.57 179.438 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -52.38 -59.91 3.85 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 179.119 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.9 mm -55.92 -28.7 24.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 178.503 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.52 -41.69 90.55 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.395 0.617 . . . . 0.0 109.433 178.243 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.32 -30.87 65.17 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.987 -1.006 . . . . 0.0 110.191 178.898 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 96.9 mt -62.74 -46.51 87.72 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 177.43 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.27 -45.7 92.4 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 114.674 -1.148 . . . . 0.0 110.253 177.556 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.97 -35.71 81.59 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.529 -179.528 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -73.65 -46.87 44.08 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.893 0.378 . . . . 0.0 110.361 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.5 mt -64.69 -27.67 69.08 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.405 179.387 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -61.15 -46.98 88.32 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.151 -179.575 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 5.4 mtmm . . . . . 0 C--N 1.326 -0.456 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.976 179.649 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 6.1 tmm? . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.835 0.35 . . . . 0.0 110.909 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -120.34 124.38 45.41 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.165 -179.863 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 49.2 mt -120.39 125.95 74.72 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.849 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -132.87 160.66 36.33 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.986 179.729 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 21.9 p -163.35 142.02 8.14 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.745 -179.468 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.7 mmtm -103.92 16.15 26.98 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.353 -179.795 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 17.6 mt-30 -141.92 23.02 2.09 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 120.791 0.329 . . . . 0.0 111.031 179.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 176.46 -178.26 0.15 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.654 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -121.12 163.04 19.02 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.784 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 3.8 mm -91.18 118.19 35.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.937 0.398 . . . . 0.0 110.877 -179.748 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 19.2 p -100.21 159.26 30.27 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.871 179.739 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_exo -62.58 -13.3 32.73 Favored 'Trans proline' 0 C--N 1.344 0.291 0 C-N-CA 122.611 2.207 . . . . 0.0 112.215 179.479 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -90.23 -38.59 13.33 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.025 0.441 . . . . 0.0 110.678 179.537 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 19.3 mt -72.89 -32.38 39.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.758 -0.656 . . . . 0.0 109.513 179.194 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.41 ' CG ' ' N ' ' A' ' 17' ' ' GLN . 23.2 ptt180 -71.54 -45.73 61.53 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.538 178.86 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.41 ' N ' ' CG ' ' A' ' 16' ' ' ARG . 6.0 tp-100 -67.02 -35.85 80.82 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.492 179.014 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.467 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 68.0 t60 -58.3 -64.03 1.06 Allowed 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 178.682 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 15.2 t -61.43 -45.32 98.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.663 178.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.623 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -55.52 -49.28 73.04 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.678 179.751 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.467 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 3.0 p30 -59.13 -29.24 67.26 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.822 0.344 . . . . 0.0 110.641 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 41.8 mmt180 -74.77 -28.03 60.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.528 179.339 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.623 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 1.3 mt -68.85 -48.55 63.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.964 0.412 . . . . 0.0 110.102 178.794 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.97 -26.25 65.86 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.793 179.473 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 15.6 tttp -78.51 -32.04 47.89 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.649 179.492 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 5.4 mt . . . . . 0 C--N 1.327 -0.377 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.713 179.695 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo . . . . . 0 N--CA 1.454 -0.847 0 N-CA-C 109.92 -0.838 . . . . 0.0 109.92 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -98.63 130.47 45.15 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -177.877 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 5.5 mm -121.48 132.65 70.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.342 -0.844 . . . . 0.0 109.766 178.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 26.6 mt -119.96 148.08 23.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 121.0 0.428 . . . . 0.0 111.868 -179.232 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.6 mt -123.38 127.18 48.1 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.629 179.59 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -124.8 -170.76 2.22 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.725 -179.889 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.458 ' HG2' ' N ' ' A' ' 43' ' ' GLU . 1.6 tttp -170.5 145.05 2.53 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.304 0.574 . . . . 0.0 110.932 -179.786 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.458 ' N ' ' HG2' ' A' ' 42' ' ' LYS . 3.3 mm-40 -130.24 163.87 44.88 Favored Pre-proline 0 C--N 1.323 -0.576 0 CA-C-N 115.457 -0.792 . . . . 0.0 108.927 178.871 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . 0.444 ' HD2' ' HB3' ' A' ' 43' ' ' GLU . 5.0 Cg_endo -48.14 -21.96 3.32 Favored 'Trans proline' 0 N--CA 1.463 -0.287 0 C-N-CA 122.073 1.848 . . . . 0.0 112.166 -179.359 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -83.73 -75.15 0.34 Allowed 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.212 179.291 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . 0.437 ' HA3' ' HA ' ' A' ' 67' ' ' GLU . . . -143.89 -156.67 6.88 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.814 -179.31 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.453 ' CE2' ' HG3' ' A' ' 42' ' ' LYS . 22.8 m-85 -107.69 151.38 25.75 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.654 0.74 . . . . 0.0 112.476 -179.32 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.427 ' HA ' ' HA ' ' A' ' 65' ' ' LYS . 78.6 t -124.46 140.93 46.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 114.525 -1.216 . . . . 0.0 110.424 -179.875 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.429 ' O ' ' HA ' ' A' ' 63' ' ' SER . . . -132.08 125.1 30.55 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.64 -0.255 . . . . 0.0 110.922 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 -117.77 148.58 41.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.465 179.652 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . 0.429 ' N ' HD11 ' A' ' 76' ' ' LEU . . . -144.58 142.52 30.23 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.968 0.413 . . . . 0.0 111.771 -179.802 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.1 m -135.26 131.32 36.45 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.839 179.334 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 21.3 mt -133.35 138.84 50.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.119 0.485 . . . . 0.0 111.842 -179.159 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 18.9 m120 -102.28 119.18 38.37 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.648 179.3 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' THR . . . . . 0.436 ' HB ' ' HD2' ' A' ' 56' ' ' PRO . 6.1 p -113.82 162.35 23.14 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.295 179.673 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . 0.436 ' HD2' ' HB ' ' A' ' 55' ' ' THR . 68.9 Cg_endo -76.22 -3.17 13.49 Favored 'Trans proline' 0 N--CA 1.463 -0.318 0 C-N-CA 122.211 1.94 . . . . 0.0 112.517 -179.857 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -129.63 23.47 5.44 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.202 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 140.4 -167.4 25.52 Favored Glycine 0 C--N 1.33 0.239 0 C-N-CA 120.54 -0.838 . . . . 0.0 112.778 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 21.3 t -131.55 147.27 32.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.766 0.317 . . . . 0.0 111.11 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 13.0 mt -120.65 141.97 49.87 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.29 -179.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 21.7 t -141.21 139.96 32.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.758 179.74 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -151.42 159.5 44.2 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.296 0.569 . . . . 0.0 111.857 -179.557 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' SER . . . . . 0.429 ' HA ' ' O ' ' A' ' 49' ' ' ALA . 2.4 p -145.58 154.89 42.66 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.281 -0.872 . . . . 0.0 111.678 -179.306 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -148.31 105.05 0.3 Allowed Glycine 0 C--N 1.332 0.358 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.551 179.341 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.427 ' HA ' ' HA ' ' A' ' 48' ' ' VAL . 5.3 mttp -105.97 44.9 1.0 Allowed 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 112.401 0.519 . . . . 0.0 112.401 -178.683 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . 0.414 ' ND1' ' CG2' ' A' ' 71' ' ' THR . 12.6 t-80 -76.64 155.69 33.26 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.757 0.313 . . . . 0.0 110.309 178.582 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.437 ' HA ' ' HA3' ' A' ' 46' ' ' GLY . 10.8 mt-10 -61.63 -26.34 67.94 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.787 0.327 . . . . 0.0 111.223 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -97.61 122.63 40.91 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.083 0.468 . . . . 0.0 111.475 -179.364 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -47.71 -49.91 26.59 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.772 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 40.3 m-85 -66.19 -37.45 85.63 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.711 -179.087 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.414 ' CG2' ' ND1' ' A' ' 66' ' ' HIS . 94.1 m -64.22 -41.61 96.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.774 0.321 . . . . 0.0 110.655 -179.859 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.83 -47.91 82.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.491 179.455 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 31.0 mt -60.19 -48.08 89.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.624 179.715 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -64.05 -39.78 94.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.752 179.767 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -65.12 -44.34 89.03 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.536 179.678 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.429 HD11 ' N ' ' A' ' 51' ' ' ALA . 0.3 OUTLIER -54.21 -57.6 10.54 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.504 -0.317 . . . . 0.0 110.373 179.397 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 61.6 mt -56.63 -30.88 33.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 N-CA-C 110.162 -0.311 . . . . 0.0 110.162 179.218 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -58.66 -36.55 74.32 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.513 0.673 . . . . 0.0 109.571 178.403 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.6 -28.04 58.75 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.8 -1.091 . . . . 0.0 110.024 179.258 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 77.7 mt -62.79 -49.6 74.34 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 177.438 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -62.68 -46.13 89.6 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 114.293 -1.321 . . . . 0.0 110.744 177.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.74 -37.53 86.93 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.939 -179.433 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 44.3 mt-30 -75.71 -37.7 59.2 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.884 0.373 . . . . 0.0 110.803 179.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.2 mt -64.24 -25.37 68.03 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.695 179.668 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -64.15 -28.0 69.46 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.538 179.661 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 16.2 mmtt . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.102 179.989 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 3.2 mpp? . . . . . 0 C--O 1.232 0.143 0 CA-C-O 120.847 0.356 . . . . 0.0 110.916 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -122.91 114.27 20.22 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.26 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 36.4 mt -123.55 123.86 68.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.68 179.617 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -134.99 157.5 46.78 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.998 0.428 . . . . 0.0 111.366 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 22.4 p -164.69 139.59 5.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.436 -179.761 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -102.03 25.31 8.9 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.188 -179.736 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -140.89 15.53 2.3 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.164 179.648 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER 173.72 -177.33 0.08 Allowed 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.984 0.421 . . . . 0.0 110.74 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -110.69 172.51 6.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.651 179.838 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.8 mm -91.01 113.22 26.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 121.009 0.433 . . . . 0.0 111.173 -179.579 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 12.5 p -98.83 157.39 34.24 Favored Pre-proline 0 C--N 1.327 -0.405 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.959 179.809 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -62.55 -13.51 33.9 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.579 2.186 . . . . 0.0 111.984 179.204 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -86.1 -41.01 15.11 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.058 0.456 . . . . 0.0 110.428 179.397 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 24.5 mt -72.7 -29.29 29.72 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.29 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.813 179.265 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 2.2 ptm180 -74.99 -43.4 54.15 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.868 -0.605 . . . . 0.0 109.544 178.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -67.39 -37.94 83.91 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.696 178.922 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.476 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 82.1 t60 -60.63 -53.65 54.86 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 178.55 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.772 ' O ' ' HG3' ' A' ' 22' ' ' ARG . 23.9 t -62.55 -49.28 84.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.209 178.312 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.542 ' HA ' ' CG ' ' A' ' 23' ' ' LEU . . . -55.65 -37.91 68.85 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.759 -0.376 . . . . 0.0 111.875 179.762 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.476 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 0.9 OUTLIER -64.37 -32.53 74.18 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.37 -0.532 . . . . 0.0 110.477 179.335 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.772 ' HG3' ' O ' ' A' ' 19' ' ' VAL . 0.0 OUTLIER -77.9 -39.72 42.14 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.914 -0.585 . . . . 0.0 112.486 -179.283 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.542 ' CG ' ' HA ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER -65.24 -48.51 73.04 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 120.034 -0.666 . . . . 0.0 110.843 -179.463 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.31 -24.79 66.68 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.15 179.556 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 2.9 tppp? -79.14 -34.29 43.39 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.854 179.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.908 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo . . . . . 0 N--CA 1.463 -0.289 0 N-CA-C 111.433 -0.257 . . . . 0.0 111.433 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 2.2 t-160 -134.4 130.97 37.65 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.125 0.488 . . . . 0.0 111.635 -179.455 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 9.1 mm -120.13 133.76 65.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.388 179.495 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 2.1 mp -119.11 146.26 24.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.002 -179.815 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 45.8 mt -124.13 126.85 46.88 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.888 179.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -123.65 -173.93 2.86 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.398 179.696 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.414 ' HG3' ' CD2' ' A' ' 47' ' ' PHE . 15.1 tttt -159.7 140.66 12.45 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.425 0.631 . . . . 0.0 111.489 -179.667 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -131.58 156.82 79.62 Favored Pre-proline 0 C--N 1.323 -0.566 0 CA-C-N 114.934 -1.03 . . . . 0.0 109.195 179.15 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_exo -52.12 -24.47 20.15 Favored 'Trans proline' 0 N--CA 1.465 -0.183 0 C-N-CA 121.854 1.703 . . . . 0.0 112.418 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -89.64 -6.71 55.93 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.499 -0.773 . . . . 0.0 112.833 -179.178 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 149.94 -164.35 29.57 Favored Glycine 0 C--O 1.224 -0.503 0 C-N-CA 120.214 -0.993 . . . . 0.0 112.154 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.414 ' CD2' ' HG3' ' A' ' 42' ' ' LYS . 18.3 m-85 -108.35 153.63 22.99 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.57 0.7 . . . . 0.0 111.854 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 54.1 t -127.36 140.7 48.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 114.82 -1.082 . . . . 0.0 111.023 -179.281 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -131.84 124.11 28.92 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.677 179.682 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 67.8 m-20 -118.89 147.33 44.11 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.685 0.278 . . . . 0.0 110.743 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -144.97 141.19 28.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.875 0.369 . . . . 0.0 111.547 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 6.4 m -135.29 133.49 38.94 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.361 179.576 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 1.1 mm -132.31 134.38 59.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.843 0.354 . . . . 0.0 111.13 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 23.7 m120 -103.24 118.29 36.45 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.438 179.026 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 30.3 p -113.61 153.98 45.73 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.877 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_exo -61.87 -15.46 43.02 Favored 'Trans proline' 0 C--N 1.343 0.263 0 C-N-CA 122.564 2.176 . . . . 0.0 112.655 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 -118.89 21.98 12.17 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.616 -0.265 . . . . 0.0 111.691 -179.546 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 141.84 -165.46 26.52 Favored Glycine 0 C--N 1.33 0.243 0 C-N-CA 120.376 -0.916 . . . . 0.0 113.053 179.756 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 12.5 t -142.24 142.29 27.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.822 0.344 . . . . 0.0 111.02 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -117.64 148.99 41.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.192 -179.792 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 12.4 t -138.87 145.6 27.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.874 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -153.43 150.97 29.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.168 0.509 . . . . 0.0 111.604 -179.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 11.5 p -143.04 158.7 43.36 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.643 -179.41 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -153.46 109.77 0.42 Allowed Glycine 0 C--N 1.33 0.232 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.61 179.639 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 60.7 mttt -110.68 45.14 1.17 Allowed 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -178.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 12.3 t-80 -75.79 156.36 34.61 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 110.207 -0.294 . . . . 0.0 110.207 178.543 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -61.1 -26.7 67.84 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.72 0.295 . . . . 0.0 111.295 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . 0.401 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 12.0 t70 -98.53 120.8 39.57 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.023 0.439 . . . . 0.0 111.371 -179.378 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 13.2 ttt -48.04 -50.72 26.94 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.953 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -65.56 -40.23 92.6 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.268 -179.296 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.401 ' HB ' ' HB3' ' A' ' 68' ' ' ASP . 37.9 m -64.74 -40.44 95.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.801 0.334 . . . . 0.0 110.679 179.891 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.17 -49.36 76.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.648 179.506 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 12.9 mt -60.4 -45.1 97.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.878 0.37 . . . . 0.0 110.266 179.512 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -64.45 -37.82 88.85 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.261 179.264 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -65.85 -42.23 90.71 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.183 179.233 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -53.57 -56.24 18.78 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 178.4 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.448 ' CD1' ' HG2' ' A' ' 22' ' ' ARG . 37.4 mt -56.79 -30.63 33.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.17 178.493 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -57.93 -35.77 71.55 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.548 0.69 . . . . 0.0 109.305 178.241 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.3 mptp? -78.92 -31.27 45.16 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 114.7 -1.136 . . . . 0.0 110.208 179.065 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 76.4 mt -63.07 -50.39 70.76 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 177.775 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -60.46 -47.6 85.42 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 114.942 -1.027 . . . . 0.0 110.22 177.522 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 59.7 mtt180 -62.96 -24.57 67.95 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.819 179.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 7.2 mt-30 -75.44 -44.24 45.4 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.615 179.757 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 28.3 mt -64.79 -27.4 68.86 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.835 179.866 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -63.55 -33.06 74.76 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.018 0.437 . . . . 0.0 110.549 179.75 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 18.6 mmtt . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.966 179.907 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' MET . . . . . 0.437 ' HA ' ' HG2' ' A' ' 36' ' ' PRO . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.812 0.339 . . . . 0.0 111.054 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -116.7 136.43 52.97 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.483 -179.497 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.413 ' CD1' ' CE ' ' A' ' 2' ' ' MET . 34.7 mt -126.27 125.39 67.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.408 179.386 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -134.35 161.2 35.65 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.869 0.366 . . . . 0.0 111.18 179.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 29.1 p -163.38 138.3 6.33 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.551 -179.45 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 20.3 mttt -101.74 31.48 3.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.931 -179.769 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -141.19 -47.48 0.39 Allowed 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.805 179.743 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 1.5 mpp? -120.37 -170.36 1.97 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.748 179.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -118.41 164.96 14.47 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.572 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.1 mm -89.95 115.1 28.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 121.073 0.463 . . . . 0.0 110.945 -179.576 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 20.1 p -100.35 155.81 35.97 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.924 179.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_exo -59.56 -17.51 42.03 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.39 2.06 . . . . 0.0 111.822 179.147 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.01 -40.47 22.06 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-O 121.108 0.48 . . . . 0.0 110.226 179.21 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 19.1 mt -73.42 -28.72 25.88 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.594 179.019 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.57 -45.01 48.12 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.169 178.819 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 42.9 tt0 -67.74 -37.32 82.01 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.371 178.809 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.438 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 57.6 t60 -59.29 -60.02 4.53 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 178.648 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.3 t -60.77 -45.36 97.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 110.142 -0.318 . . . . 0.0 110.142 178.396 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.672 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -57.65 -42.07 82.72 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.538 179.394 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.438 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 0.9 OUTLIER -59.67 -33.23 71.29 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 121.075 0.464 . . . . 0.0 110.043 179.607 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 19.8 mmm180 -74.15 -26.07 60.1 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.516 179.316 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.672 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 14.7 mt -66.44 -53.12 39.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.016 0.436 . . . . 0.0 109.942 178.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.77 -22.25 63.89 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.757 179.057 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 6.5 tptp -78.8 -28.08 44.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.15 179.191 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 33.5 mt . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.824 -179.844 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.437 ' HG2' ' HA ' ' A' ' 2' ' ' MET . 19.4 Cg_endo . . . . . 0 C--O 1.231 0.155 0 CA-C-O 120.356 0.065 . . . . 0.0 112.052 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -140.11 126.95 20.63 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.549 -0.46 . . . . 0.0 111.865 -179.814 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.402 ' N ' ' CD1' ' A' ' 38' ' ' ILE . 3.4 mp -119.34 138.35 50.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.418 179.323 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 22.1 mm -116.05 148.38 18.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.46 -179.485 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 11.0 mt -122.88 127.19 48.65 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.518 179.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 11.7 m -125.33 -171.16 2.31 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.789 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.456 ' CD ' ' CE2' ' A' ' 47' ' ' PHE . 5.2 ttpt -173.58 146.63 1.34 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.128 0.49 . . . . 0.0 110.765 -179.791 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -132.04 170.5 11.15 Favored Pre-proline 0 C--N 1.324 -0.506 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.299 179.228 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_exo -51.45 -19.7 7.43 Favored 'Trans proline' 0 N--CA 1.464 -0.241 0 C-N-CA 121.727 1.618 . . . . 0.0 112.302 -179.502 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.12 -77.95 0.29 Allowed 'General case' 0 N--CA 1.445 -0.724 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.104 179.344 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . 0.42 ' HA3' ' HA ' ' A' ' 67' ' ' GLU . . . -141.77 -155.68 6.55 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.859 -179.309 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.456 ' CE2' ' CD ' ' A' ' 42' ' ' LYS . 21.9 m-85 -108.94 151.13 26.72 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-O 121.639 0.733 . . . . 0.0 112.699 -179.232 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 75.7 t -124.98 141.45 45.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 114.482 -1.236 . . . . 0.0 110.517 -179.659 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -132.44 124.09 27.94 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.654 -0.248 . . . . 0.0 110.797 179.787 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 21.2 m-20 -119.04 149.19 42.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.602 -0.272 . . . . 0.0 110.547 179.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . 0.419 ' N ' HD12 ' A' ' 76' ' ' LEU . . . -146.69 140.42 25.92 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.829 0.347 . . . . 0.0 111.317 179.849 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.6 m -135.12 131.56 37.02 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.033 179.402 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 17.4 mt -133.33 136.4 54.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 121.013 0.435 . . . . 0.0 111.456 -179.547 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -103.6 131.28 50.88 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.148 178.963 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' THR . . . . . 0.519 ' HB ' ' HD2' ' A' ' 56' ' ' PRO . 5.8 p -127.83 163.33 43.98 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.444 -179.904 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . 0.519 ' HD2' ' HB ' ' A' ' 55' ' ' THR . 53.6 Cg_endo -70.83 -5.67 17.41 Favored 'Trans proline' 0 C--N 1.343 0.25 0 C-N-CA 122.321 2.014 . . . . 0.0 112.687 179.921 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 67.7 m-80 -124.82 22.12 8.19 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.685 -0.234 . . . . 0.0 111.379 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 133.68 -167.76 23.46 Favored Glycine 0 C--N 1.33 0.212 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.784 179.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 14.1 t -137.24 144.7 31.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 120.665 0.269 . . . . 0.0 111.008 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.7 mp -119.34 152.4 36.82 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.108 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.435 ' O ' ' NE2' ' A' ' 83' ' ' GLN . 9.3 p -143.0 145.36 22.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.866 179.7 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -152.01 156.82 40.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.054 0.454 . . . . 0.0 111.814 -179.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 4.0 m -145.04 156.05 43.71 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.858 -179.155 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -150.15 105.38 0.29 Allowed Glycine 0 CA--C 1.519 0.324 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.445 179.355 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 2.1 mtpp -108.68 45.9 1.0 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.57 0.581 . . . . 0.0 112.57 -178.618 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . 0.412 ' CE1' HG22 ' A' ' 71' ' ' THR . 12.8 t-80 -76.73 156.52 32.4 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.795 0.331 . . . . 0.0 110.28 178.547 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.42 ' HA ' ' HA3' ' A' ' 46' ' ' GLY . 2.0 pt-20 -61.89 -26.98 68.48 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.798 0.333 . . . . 0.0 111.3 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -97.68 123.12 41.47 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.106 0.479 . . . . 0.0 111.564 -179.313 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 26.0 ttt -48.35 -49.14 35.51 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.693 179.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 -66.32 -38.78 88.47 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.466 -179.211 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.412 HG22 ' CE1' ' A' ' 66' ' ' HIS . 84.7 m -64.53 -41.51 96.33 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.719 -179.889 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.78 -48.7 79.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.646 179.599 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 25.4 mt -60.34 -46.85 94.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 120.891 0.377 . . . . 0.0 110.564 179.647 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -64.16 -39.2 93.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.615 179.558 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -65.46 -47.4 76.27 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.363 179.533 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.419 HD12 ' N ' ' A' ' 51' ' ' ALA . 0.5 OUTLIER -50.75 -57.82 7.42 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 179.204 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 22.9 mm -56.04 -32.16 32.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 178.482 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -59.94 -27.83 67.12 Favored 'General case' 0 N--CA 1.442 -0.839 0 CA-C-O 121.099 0.476 . . . . 0.0 110.596 178.487 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.99 -26.87 23.57 Favored 'General case' 0 CA--C 1.521 -0.135 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.219 179.27 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 57.0 mt -62.87 -51.03 68.57 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 108.004 -1.109 . . . . 0.0 108.004 177.6 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -61.2 -44.83 96.65 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 114.567 -1.197 . . . . 0.0 110.778 177.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.51 -38.78 91.26 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.005 -179.356 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . 0.435 ' NE2' ' O ' ' A' ' 61' ' ' VAL . 42.5 mt-30 -74.23 -39.15 63.27 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.874 0.369 . . . . 0.0 110.738 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.9 mt -64.96 -26.88 68.49 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.814 179.599 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 39.6 t30 -62.3 -38.15 88.28 Favored 'General case' 0 CA--C 1.523 -0.09 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.315 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 19.7 mttt . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.975 179.958 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.863 0.364 . . . . 0.0 110.921 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 31.5 t-20 -121.89 119.06 30.49 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.42 -179.52 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.443 HD13 HG23 ' A' ' 4' ' ' ILE . 36.4 mt -118.27 123.73 72.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.476 179.363 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -134.67 160.44 38.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.97 0.414 . . . . 0.0 111.281 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 21.6 p -163.92 142.42 7.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.584 -179.67 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 10.6 mttt -100.9 28.49 5.2 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.892 -179.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 3.5 tp-100 -141.25 -46.08 0.38 Allowed 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.622 179.692 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 5.4 mpp? -114.0 -176.81 2.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.683 179.764 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -120.52 169.74 10.05 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.518 179.819 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.714 ' CD1' ' N ' ' A' ' 11' ' ' ILE . 0.3 OUTLIER -88.44 101.69 12.01 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.012 0 CA-C-O 121.547 0.689 . . . . 0.0 110.623 -178.474 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 17.6 p -95.55 151.1 38.32 Favored Pre-proline 0 C--N 1.322 -0.606 0 CA-C-N 114.695 -1.139 . . . . 0.0 110.877 179.735 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -54.78 -26.64 48.52 Favored 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 122.438 2.092 . . . . 0.0 111.803 179.182 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -74.48 -44.48 51.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.578 179.406 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 21.3 mt -72.18 -27.78 27.66 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.326 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 178.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.5 -44.94 33.13 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.549 -0.751 . . . . 0.0 109.728 178.772 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 43.9 tt0 -67.67 -40.46 84.44 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.762 179.114 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.537 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 77.8 t60 -60.62 -58.02 10.23 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 179.167 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 25.2 t -60.7 -47.87 91.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.693 0.282 . . . . 0.0 110.32 178.704 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.697 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -59.04 -40.6 85.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.226 -0.443 . . . . 0.0 112.039 179.662 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.537 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 0.9 OUTLIER -59.7 -35.1 73.82 Favored 'General case' 0 C--N 1.332 -0.166 0 C-N-CA 120.512 -0.475 . . . . 0.0 109.887 179.737 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 5.6 mmm180 -76.53 -27.36 55.94 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.658 179.567 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.697 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 3.5 mt -68.54 -58.21 4.63 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.083 0.468 . . . . 0.0 110.529 179.687 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.65 -23.73 65.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.314 179.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 6.8 tmtt? -79.42 -29.79 42.05 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.132 0.491 . . . . 0.0 110.462 179.541 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 6.9 mt . . . . . 0 C--N 1.328 -0.354 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.077 -179.802 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo . . . . . 0 N--CA 1.463 -0.319 0 CA-C-O 120.82 0.259 . . . . 0.0 111.524 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 1.7 t-160 -107.43 129.79 54.89 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.07 0.462 . . . . 0.0 111.778 -179.261 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 3.4 mp -121.09 133.17 68.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.526 179.45 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 5.2 mt -118.89 149.2 21.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.228 -179.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 8.9 mt -124.93 126.86 46.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.89 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 34.6 m -123.49 -173.83 2.82 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.507 179.739 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.434 ' HG3' ' CD2' ' A' ' 47' ' ' PHE . 3.4 ttpt -160.48 139.05 10.22 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.306 0.574 . . . . 0.0 111.333 -179.644 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -130.76 156.56 79.71 Favored Pre-proline 0 C--N 1.323 -0.583 0 CA-C-N 115.129 -0.941 . . . . 0.0 109.281 179.146 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_exo -51.34 -24.55 16.11 Favored 'Trans proline' 0 C--O 1.232 0.187 0 C-N-CA 121.974 1.783 . . . . 0.0 112.481 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -89.07 -6.2 57.29 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.456 -0.793 . . . . 0.0 112.662 -179.242 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 149.16 -161.55 28.76 Favored Glycine 0 C--O 1.224 -0.48 0 C-N-CA 120.245 -0.979 . . . . 0.0 112.129 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.434 ' CD2' ' HG3' ' A' ' 42' ' ' LYS . 16.9 m-85 -110.36 154.59 23.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.523 0.678 . . . . 0.0 111.98 179.923 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 68.8 t -128.08 139.34 52.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 114.867 -1.06 . . . . 0.0 110.94 -179.266 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.422 ' O ' ' HA ' ' A' ' 63' ' ' SER . . . -131.27 124.51 30.65 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.761 179.715 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -118.96 147.98 43.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.743 0.306 . . . . 0.0 110.999 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . 0.445 ' N ' HD12 ' A' ' 76' ' ' LEU . . . -144.29 141.42 29.79 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.558 179.886 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.1 m -135.79 130.3 33.83 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.014 179.4 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 11.7 mt -130.54 134.19 62.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 120.825 0.345 . . . . 0.0 110.904 -179.54 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -104.24 133.49 49.07 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.68 179.623 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 6.3 p -134.29 135.25 23.7 Favored Pre-proline 0 C--N 1.326 -0.421 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.347 179.476 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_exo -45.87 -20.81 0.81 Allowed 'Trans proline' 0 CA--C 1.53 0.29 0 C-N-CA 122.381 2.054 . . . . 0.0 112.921 179.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -111.48 20.69 16.97 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 112.095 0.406 . . . . 0.0 112.095 -179.571 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 142.44 -174.71 23.25 Favored Glycine 0 C--N 1.332 0.342 0 C-N-CA 120.286 -0.959 . . . . 0.0 113.319 179.52 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 21.2 t -143.85 139.62 25.35 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-O 120.789 0.328 . . . . 0.0 111.005 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.5 mp -117.85 153.76 32.97 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.009 0.433 . . . . 0.0 111.612 -179.418 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 16.7 t -140.49 145.64 25.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.714 179.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -153.15 152.57 31.42 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.189 0.519 . . . . 0.0 111.841 -179.579 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' SER . . . . . 0.422 ' HA ' ' O ' ' A' ' 49' ' ' ALA . 0.1 OUTLIER -144.89 158.08 43.93 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.666 -179.437 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -151.55 105.28 0.28 Allowed Glycine 0 C--N 1.331 0.298 0 N-CA-C 111.497 -0.641 . . . . 0.0 111.497 179.341 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -106.71 44.83 1.02 Allowed 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.281 0.474 . . . . 0.0 112.281 -178.834 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 16.5 t-80 -75.4 156.36 35.45 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.635 -0.257 . . . . 0.0 110.317 178.601 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -59.61 -28.62 67.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.489 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 9.0 t0 -97.98 119.6 36.9 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.972 0.415 . . . . 0.0 111.566 -179.292 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 3.7 ttt -47.86 -47.01 31.84 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.516 179.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 35.5 m-85 -66.45 -42.28 87.82 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.151 -179.521 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 56.7 m -65.33 -37.4 86.98 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.669 179.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.4 -50.6 70.88 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.747 179.588 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 6.7 mt -61.97 -41.3 90.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 179.412 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -64.44 -41.45 96.56 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.062 179.091 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -66.31 -39.43 89.31 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.496 179.367 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.445 HD12 ' N ' ' A' ' 51' ' ' ALA . 0.4 OUTLIER -54.97 -63.73 1.06 Allowed 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 179.079 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 4.8 mt -54.64 -26.89 17.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 110.274 -0.269 . . . . 0.0 110.274 178.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.23 -40.22 85.21 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-O 121.48 0.657 . . . . 0.0 109.282 178.087 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 7.3 mmtm -73.94 -31.38 63.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 114.916 -1.038 . . . . 0.0 110.205 178.817 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 84.7 mt -62.88 -47.38 83.57 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 107.817 -1.179 . . . . 0.0 107.817 177.593 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -60.73 -46.25 91.14 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 114.821 -1.082 . . . . 0.0 110.32 177.65 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.42 -31.24 72.34 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.741 -179.858 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 -74.81 -45.32 44.29 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.942 0.401 . . . . 0.0 110.436 179.684 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.4 mt -65.28 -26.17 67.96 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.865 179.681 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -62.71 -31.94 72.95 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.055 0.455 . . . . 0.0 110.357 179.647 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.246 179.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.526 0.04 0 CA-C-O 120.826 0.346 . . . . 0.0 110.694 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -124.45 130.52 52.62 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.297 -179.666 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 39.6 mt -136.2 124.82 37.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.667 179.621 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -134.45 160.74 37.04 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.941 0.401 . . . . 0.0 111.255 -179.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 21.9 p -162.67 145.75 11.09 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.39 -179.474 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.47 30.05 4.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.404 -179.47 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -142.39 -53.87 0.42 Allowed 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.806 179.579 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 2.1 mpp? -109.23 -176.68 3.09 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.803 179.8 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -115.72 168.74 9.76 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.666 179.754 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 5.1 mm -90.5 114.01 27.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 121.043 0.449 . . . . 0.0 111.143 -179.385 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 13.6 p -99.8 157.72 33.4 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.911 179.632 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -61.7 -15.76 44.21 Favored 'Trans proline' 0 C--N 1.343 0.265 0 C-N-CA 122.482 2.121 . . . . 0.0 111.88 179.056 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -83.15 -41.06 18.94 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-O 121.019 0.438 . . . . 0.0 110.263 179.181 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 42.2 mt -72.79 -29.09 28.73 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.285 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 178.801 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.43 ' O ' ' CB ' ' A' ' 20' ' ' ALA . 75.9 mtt180 -73.45 -47.33 42.35 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.521 178.667 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -67.15 -38.46 85.54 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.89 179.149 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.508 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 75.5 t60 -59.53 -62.7 1.68 Allowed 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.872 -0.418 . . . . 0.0 109.872 179.17 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.446 ' O ' ' HG ' ' A' ' 23' ' ' LEU . 22.6 t -60.82 -47.57 92.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.735 178.95 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.663 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -56.68 -44.84 81.85 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 111.855 0.317 . . . . 0.0 111.855 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.508 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 1.1 p30 -59.34 -32.97 70.58 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.044 0.449 . . . . 0.0 110.408 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 31.3 mmt180 -75.13 -28.85 60.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.859 179.793 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.663 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 3.5 mt -69.17 -54.43 14.91 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.96 0.41 . . . . 0.0 110.659 179.653 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.51 -25.93 62.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.103 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.3 -32.3 43.48 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.268 0.556 . . . . 0.0 109.875 178.965 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 31.6 mt . . . . . 0 C--N 1.33 -0.256 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.673 179.757 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo . . . . . 0 N--CA 1.462 -0.35 0 CA-C-O 120.835 0.264 . . . . 0.0 112.241 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 1.7 t-160 -136.68 128.77 29.59 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.918 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 3.7 mp -120.61 137.52 54.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.2 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 4.3 mp -114.7 148.28 17.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.877 179.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 10.0 mt -123.34 127.5 48.59 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.939 0.4 . . . . 0.0 111.018 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -125.06 -170.97 2.26 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.645 179.918 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.463 ' HG2' ' N ' ' A' ' 43' ' ' GLU . 2.7 ttmm -171.35 145.12 2.09 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.202 0.525 . . . . 0.0 111.039 -179.855 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.463 ' N ' ' HG2' ' A' ' 42' ' ' LYS . 2.2 mm-40 -130.1 166.28 27.64 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.015 178.816 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . 0.405 ' HD2' ' HB3' ' A' ' 43' ' ' GLU . 80.1 Cg_exo -48.72 -19.84 2.38 Favored 'Trans proline' 0 N--CA 1.463 -0.28 0 C-N-CA 121.837 1.691 . . . . 0.0 112.622 -178.946 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -85.38 -77.21 0.3 Allowed 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.004 179.078 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . 0.43 ' HA3' ' HA ' ' A' ' 67' ' ' GLU . . . -142.37 -153.69 5.97 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.629 -179.409 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.456 ' CE2' ' HG3' ' A' ' 42' ' ' LYS . 21.6 m-85 -109.29 150.5 27.88 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-O 121.709 0.766 . . . . 0.0 112.583 -179.354 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.412 ' HA ' ' HA ' ' A' ' 65' ' ' LYS . 59.8 t -124.37 140.39 47.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 114.397 -1.274 . . . . 0.0 110.254 179.955 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -131.62 124.98 31.07 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.66 0.267 . . . . 0.0 110.812 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -119.13 148.26 43.26 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.443 179.679 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -147.11 144.38 28.99 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.981 0.42 . . . . 0.0 112.063 179.84 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.0 m -136.75 129.29 30.26 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.704 179.163 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.415 HD13 HG21 ' A' ' 53' ' ' ILE . 9.0 mt -131.13 140.93 47.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-O 121.053 0.454 . . . . 0.0 111.716 -179.23 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -100.6 140.86 34.27 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.891 179.321 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 5.9 p -133.8 156.41 79.42 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.002 179.448 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_exo -65.24 -11.04 28.21 Favored 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 122.244 1.962 . . . . 0.0 112.659 -179.572 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 53.3 m-80 -125.92 21.4 7.55 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 111.75 0.278 . . . . 0.0 111.75 -179.605 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 143.95 -166.73 26.97 Favored Glycine 0 C--N 1.331 0.297 0 C-N-CA 120.258 -0.972 . . . . 0.0 113.181 179.627 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 16.6 t -140.13 143.63 29.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 120.68 0.276 . . . . 0.0 110.986 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.5 mp -118.01 152.16 36.05 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.919 0.39 . . . . 0.0 111.447 -179.676 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 19.6 t -140.8 147.31 22.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.881 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -153.91 156.73 38.06 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.235 0.54 . . . . 0.0 111.637 -179.724 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 26.5 p -144.4 158.22 43.86 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.738 -179.341 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -152.91 105.28 0.27 Allowed Glycine 0 C--N 1.334 0.418 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.731 179.638 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.412 ' HA ' ' HA ' ' A' ' 48' ' ' VAL . 3.0 mptt -107.1 44.93 1.02 Allowed 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -178.905 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . 0.409 ' ND1' ' CG2' ' A' ' 71' ' ' THR . 12.6 t-80 -76.21 156.46 33.58 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.802 0.335 . . . . 0.0 110.233 178.596 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.43 ' HA ' ' HA3' ' A' ' 46' ' ' GLY . 5.0 mt-10 -61.38 -26.45 67.84 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.781 0.324 . . . . 0.0 111.132 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -98.32 122.13 41.12 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.034 0.445 . . . . 0.0 111.372 -179.48 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -47.93 -49.64 29.5 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.817 179.901 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 18.4 m-85 -65.96 -37.02 84.92 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.587 -179.158 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.409 ' CG2' ' ND1' ' A' ' 66' ' ' HIS . 97.9 m -64.59 -41.52 96.19 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.695 0.283 . . . . 0.0 110.559 -179.901 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.55 -47.66 84.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.522 179.514 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 14.1 mt -60.93 -46.34 96.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.584 179.553 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -64.44 -40.73 96.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.55 179.624 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -65.73 -44.53 85.72 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.604 179.795 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -53.23 -59.39 4.62 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.368 179.402 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 44.3 mt -56.12 -29.88 28.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 N-CA-C 110.183 -0.303 . . . . 0.0 110.183 179.023 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -58.72 -38.2 77.83 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.446 0.641 . . . . 0.0 109.668 178.45 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.77 -29.17 62.05 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.01 178.937 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 94.8 mt -62.06 -48.81 78.57 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 107.759 -1.2 . . . . 0.0 107.759 177.379 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 11.9 tt0 -62.68 -44.34 96.51 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 114.514 -1.221 . . . . 0.0 110.481 177.76 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.68 -32.13 73.15 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.028 -179.367 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -74.91 -41.75 59.11 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.123 0.487 . . . . 0.0 110.38 179.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.11 -32.15 73.71 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.772 179.682 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 55.9 t30 -61.37 -33.6 73.91 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.549 -178.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 21.6 mttm . . . . . 0 C--N 1.326 -0.447 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.335 -179.753 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.528 0.11 0 CA-C-O 120.709 0.29 . . . . 0.0 110.858 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -122.11 120.67 34.94 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.879 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 12.5 tt -125.58 124.42 66.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.731 179.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 3.0 p -134.51 163.73 29.05 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.832 0.348 . . . . 0.0 111.247 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 42.3 p -163.3 131.43 3.72 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.348 -179.5 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 11.7 mttt -100.7 42.39 1.12 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.914 -179.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -140.06 -46.14 0.43 Allowed 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.505 179.572 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 10.0 mtm -134.67 -178.87 5.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.468 179.664 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -89.93 164.35 14.6 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.673 179.863 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.0 mm -90.79 116.95 33.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.936 0.398 . . . . 0.0 110.859 -179.669 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 16.0 p -100.6 146.6 32.33 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.091 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_exo -55.33 -21.22 28.36 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.36 2.04 . . . . 0.0 111.652 179.12 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -74.72 -42.33 58.53 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 121.197 0.522 . . . . 0.0 110.287 179.331 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 38.8 mt -72.31 -30.42 35.21 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.305 178.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.438 ' O ' ' CB ' ' A' ' 20' ' ' ALA . 7.9 mtt180 -73.2 -46.41 50.6 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.602 178.666 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 47.5 tt0 -66.79 -37.0 83.7 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.641 179.106 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.49 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 50.2 t60 -59.88 -65.28 0.7 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.854 0.359 . . . . 0.0 110.067 179.014 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.401 ' O ' ' HG ' ' A' ' 23' ' ' LEU . 21.6 t -60.18 -46.5 94.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.97 179.168 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.636 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -57.26 -45.34 84.09 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 179.95 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.49 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 1.5 p30 -59.46 -31.56 69.43 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 120.809 -0.356 . . . . 0.0 110.64 -179.857 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 16.6 mmt180 -74.75 -28.6 60.83 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.81 179.726 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.636 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 1.6 mt -68.32 -51.61 42.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.935 0.398 . . . . 0.0 110.362 179.326 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.29 -24.13 63.02 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.823 179.592 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 7.0 tptp -77.43 -34.05 54.73 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.29 179.339 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.404 ' CD1' ' CG2' ' A' ' 77' ' ' ILE . 0.5 OUTLIER . . . . . 0 C--N 1.33 -0.259 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.715 179.37 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 94.8 Cg_endo . . . . . 0 N--CA 1.459 -0.532 0 N-CA-C 111.132 -0.372 . . . . 0.0 111.132 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -105.07 127.36 52.85 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.065 0.46 . . . . 0.0 111.959 -179.01 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.4 ' CD1' ' N ' ' A' ' 38' ' ' ILE . 3.3 mp -120.16 134.09 64.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.062 179.168 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.485 HG23 HD11 ' A' ' 39' ' ' ILE . 39.1 mt -116.27 148.42 19.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.42 -179.635 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.2 mt -123.79 127.53 48.22 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.713 179.72 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -125.54 -170.52 2.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.712 -179.916 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.469 ' HA ' ' HA ' ' A' ' 47' ' ' PHE . 0.0 OUTLIER -171.56 145.43 2.04 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.243 0.544 . . . . 0.0 110.943 -179.833 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.469 ' HB3' ' HD2' ' A' ' 44' ' ' PRO . 2.8 mm-40 -130.38 164.9 38.01 Favored Pre-proline 0 C--N 1.323 -0.581 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.197 179.099 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . 0.469 ' HD2' ' HB3' ' A' ' 43' ' ' GLU . 3.2 Cg_endo -46.79 -21.82 1.64 Allowed 'Trans proline' 0 N--CA 1.462 -0.355 0 C-N-CA 122.239 1.959 . . . . 0.0 112.363 -179.282 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 45.5 tp60 -84.27 -78.6 0.23 Allowed 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.769 179.105 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . 0.406 ' HA3' ' HA ' ' A' ' 67' ' ' GLU . . . -141.07 -152.72 5.8 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.671 -179.288 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.469 ' HA ' ' HA ' ' A' ' 42' ' ' LYS . 19.6 m-85 -110.37 151.06 27.91 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.731 0.777 . . . . 0.0 112.819 -179.249 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 67.0 t -123.89 140.54 47.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 114.393 -1.276 . . . . 0.0 110.251 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.413 ' O ' ' HA ' ' A' ' 63' ' ' SER . . . -132.18 124.83 29.8 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.642 0.258 . . . . 0.0 111.003 -179.853 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -117.19 147.96 42.03 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.287 179.629 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . 0.422 ' N ' HD12 ' A' ' 76' ' ' LEU . . . -144.97 142.74 30.08 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.998 0.428 . . . . 0.0 111.852 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.0 m -135.02 130.18 35.27 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.848 179.324 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 16.1 mt -130.52 137.22 56.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.06 0.457 . . . . 0.0 111.464 -179.352 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -101.94 137.19 40.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.749 179.549 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 6.3 p -132.5 161.2 64.68 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.302 179.576 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_exo -68.12 -9.31 25.37 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.43 2.087 . . . . 0.0 112.582 -179.559 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -117.23 -3.71 11.46 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 111.744 0.275 . . . . 0.0 111.744 -179.773 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 158.33 -166.29 34.15 Favored Glycine 0 C--N 1.331 0.304 0 C-N-CA 120.366 -0.921 . . . . 0.0 112.754 179.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 21.2 t -134.02 140.87 45.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 120.845 0.355 . . . . 0.0 111.161 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 11.0 mt -115.54 156.91 24.88 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.027 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.412 ' O ' ' NE2' ' A' ' 83' ' ' GLN . 21.1 t -140.31 149.69 21.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.008 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -154.5 155.56 35.09 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.19 0.519 . . . . 0.0 111.544 -179.799 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' SER . . . . . 0.413 ' HA ' ' O ' ' A' ' 49' ' ' ALA . 0.5 OUTLIER -145.45 158.08 43.9 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.759 -179.277 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -151.88 109.19 0.41 Allowed Glycine 0 C--N 1.331 0.257 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.628 179.505 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -109.24 45.02 1.09 Allowed 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -178.861 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 13.0 t-80 -76.22 156.01 33.95 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.784 0.325 . . . . 0.0 110.367 178.651 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.406 ' HA ' ' HA3' ' A' ' 46' ' ' GLY . 0.3 OUTLIER -61.53 -27.52 68.67 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.723 0.297 . . . . 0.0 111.36 -179.84 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -98.2 121.47 40.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.012 0.434 . . . . 0.0 111.508 -179.39 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -47.95 -50.42 27.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.813 179.865 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 43.0 m-85 -66.85 -44.14 81.79 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.775 -179.016 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 16.8 m -63.96 -42.03 97.39 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.801 0.334 . . . . 0.0 110.883 -179.701 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.5 -47.99 83.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.715 179.611 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 16.4 mt -58.67 -44.28 89.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.96 0.41 . . . . 0.0 110.44 179.636 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -63.41 -36.11 82.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.362 179.373 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -64.85 -41.67 95.51 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.156 -0.475 . . . . 0.0 109.856 179.182 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.422 HD12 ' N ' ' A' ' 51' ' ' ALA . 0.2 OUTLIER -54.87 -59.9 4.1 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 178.878 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.404 ' CG2' ' CD1' ' A' ' 26' ' ' LEU . 6.9 mt -56.25 -30.48 30.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 110.013 -0.365 . . . . 0.0 110.013 178.727 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -59.85 -31.74 70.04 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-O 121.304 0.573 . . . . 0.0 110.157 178.196 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 7.2 mmtt -82.85 -24.87 33.06 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.485 179.162 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 93.4 mt -64.3 -47.63 78.71 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 107.574 -1.269 . . . . 0.0 107.574 177.111 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.492 ' O ' ' CD1' ' A' ' 84' ' ' LEU . 3.4 tt0 -59.31 -44.69 92.52 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 114.619 -1.173 . . . . 0.0 110.815 177.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -69.25 -37.08 77.76 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.706 -179.591 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . 0.412 ' NE2' ' O ' ' A' ' 61' ' ' VAL . 36.6 mt-30 -78.19 -48.55 15.61 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 -178.665 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.528 ' CD1' ' N ' ' A' ' 85' ' ' ASN . 0.0 OUTLIER -63.7 -14.8 55.54 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 120.672 -0.411 . . . . 0.0 111.082 -179.402 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . 0.528 ' N ' ' CD1' ' A' ' 84' ' ' LEU . 0.2 OUTLIER -67.73 -28.23 67.47 Favored 'General case' 0 N--CA 1.457 -0.099 0 CA-C-O 121.152 0.501 . . . . 0.0 110.1 178.762 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 4.0 mmtm . . . . . 0 C--N 1.331 -0.221 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.323 -179.757 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.2 ptt? . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.801 0.334 . . . . 0.0 110.867 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -121.95 128.55 51.63 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.107 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 36.9 mt -129.13 124.31 60.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.718 179.663 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -135.63 161.01 36.73 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.042 0.449 . . . . 0.0 111.397 -179.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 21.6 p -163.67 141.02 7.25 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.325 -179.682 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -100.36 27.74 5.5 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.183 -179.396 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -142.38 -45.34 0.33 Allowed 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.791 179.625 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 5.0 mpp? -113.23 -176.23 2.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.66 179.764 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -118.85 165.63 13.8 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.503 179.705 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 5.7 mm -89.73 109.3 20.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 121.149 0.499 . . . . 0.0 111.101 -179.413 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 16.1 p -98.19 159.09 31.54 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 115.428 -0.806 . . . . 0.0 110.986 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -62.54 -13.5 33.84 Favored 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 122.579 2.186 . . . . 0.0 111.919 179.006 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -86.59 -41.93 13.89 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.959 0.409 . . . . 0.0 110.597 179.483 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 25.5 mt -71.93 -31.52 40.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.844 -0.616 . . . . 0.0 109.587 179.44 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.401 ' CG ' ' N ' ' A' ' 17' ' ' GLN . 26.6 ptt180 -72.93 -44.24 61.43 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.485 178.796 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.401 ' N ' ' CG ' ' A' ' 16' ' ' ARG . 1.9 tm0? -65.62 -38.7 90.19 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.635 179.078 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.594 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 78.2 t60 -60.36 -50.05 75.16 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.48 -0.488 . . . . 0.0 109.685 178.787 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.694 ' O ' ' HG3' ' A' ' 22' ' ' ARG . 79.7 t -63.64 -44.01 98.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 177.982 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.632 ' HA ' ' HB2' ' A' ' 23' ' ' LEU . . . -63.24 -37.06 85.76 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.907 -0.317 . . . . 0.0 111.783 179.915 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.594 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 0.8 OUTLIER -60.3 -44.03 95.79 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 -179.611 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.694 ' HG3' ' O ' ' A' ' 19' ' ' VAL . 1.6 ppt_? -74.75 -16.63 60.72 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.728 0.775 . . . . 0.0 109.01 178.372 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.632 ' HB2' ' HA ' ' A' ' 20' ' ' ALA . 0.2 OUTLIER -70.2 -63.78 1.02 Allowed 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 114.387 -1.279 . . . . 0.0 109.918 178.858 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.01 -21.14 65.94 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.185 179.338 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.12 -29.81 38.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.993 0.425 . . . . 0.0 110.935 179.789 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 9.1 mt . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.028 -179.582 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo . . . . . 0 N--CA 1.463 -0.298 0 N-CA-C 111.433 -0.257 . . . . 0.0 111.433 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -134.26 133.25 40.6 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.202 0.525 . . . . 0.0 111.907 -179.14 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 13.9 mm -121.47 132.21 71.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.64 179.531 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 37.9 mt -119.69 146.74 23.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.98 -179.883 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.2 mt -124.35 126.36 45.87 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.013 0.435 . . . . 0.0 110.842 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -123.02 -173.17 2.65 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.421 179.615 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.419 ' HE3' ' CE2' ' A' ' 47' ' ' PHE . 81.9 tttt -163.55 139.28 6.6 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.386 0.612 . . . . 0.0 111.285 -179.764 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -130.85 158.79 73.95 Favored Pre-proline 0 C--N 1.323 -0.554 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.382 179.137 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_exo -52.05 -24.31 19.4 Favored 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 121.957 1.772 . . . . 0.0 112.489 179.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.26 -6.03 57.12 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.506 -0.77 . . . . 0.0 112.689 -179.107 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 148.86 -161.02 28.59 Favored Glycine 0 C--O 1.223 -0.542 0 C-N-CA 120.299 -0.953 . . . . 0.0 112.159 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.423 ' N ' ' CD1' ' A' ' 47' ' ' PHE . 18.0 m-85 -111.35 155.11 23.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.516 0.674 . . . . 0.0 111.989 -179.908 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 94.0 t -127.41 139.44 51.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 114.844 -1.071 . . . . 0.0 111.01 -179.24 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -130.65 122.41 27.33 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.447 179.4 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -119.61 147.04 44.98 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.808 0.337 . . . . 0.0 111.115 -179.616 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . 0.439 ' N ' HD12 ' A' ' 76' ' ' LEU . . . -143.56 139.43 29.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.207 179.719 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.0 m -135.95 130.54 33.84 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.294 179.674 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 23.4 mt -132.38 134.89 58.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 120.873 0.368 . . . . 0.0 111.215 -179.753 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 9.3 m120 -103.02 119.41 38.8 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.978 179.625 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 33.3 p -112.44 157.09 41.11 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.406 179.541 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -63.3 -14.25 40.89 Favored 'Trans proline' 0 C--N 1.342 0.227 0 C-N-CA 122.521 2.148 . . . . 0.0 112.643 -179.77 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 59.6 m-80 -117.77 24.17 11.23 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.463 -179.707 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 134.93 -167.58 23.98 Favored Glycine 0 C--N 1.331 0.262 0 C-N-CA 120.48 -0.867 . . . . 0.0 112.815 179.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 14.1 t -138.92 142.47 34.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 120.703 0.287 . . . . 0.0 110.956 -179.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 16.3 mt -116.5 151.21 36.56 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.033 -179.79 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 15.0 p -139.47 148.18 23.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.086 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -154.5 149.59 26.9 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.132 0.491 . . . . 0.0 111.559 -179.721 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 6.3 m -143.99 158.26 43.82 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.662 -179.437 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -150.48 105.34 0.29 Allowed Glycine 0 C--N 1.332 0.359 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.659 179.456 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -103.75 45.04 0.98 Allowed 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.14 0.422 . . . . 0.0 112.14 -178.904 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 12.5 t-80 -76.27 155.93 33.91 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.62 -0.264 . . . . 0.0 110.437 178.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -60.31 -28.0 67.77 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.587 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 7.2 t0 -98.29 120.13 38.17 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.957 0.408 . . . . 0.0 111.526 -179.308 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 24.2 ttt -48.05 -47.24 33.83 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.608 179.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -66.28 -41.21 90.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.101 -179.584 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 76.8 m -65.22 -37.22 86.6 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.416 -0.357 . . . . 0.0 110.613 179.779 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.08 -50.77 69.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.689 179.626 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 7.8 mt -62.08 -41.98 93.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 179.262 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -63.86 -39.86 95.2 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 178.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.443 ' HA ' ' HB3' ' A' ' 78' ' ' ASN . 5.3 mt-10 -66.88 -41.11 87.8 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.39 179.207 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.439 HD12 ' N ' ' A' ' 51' ' ' ALA . 0.2 OUTLIER -53.2 -61.65 2.16 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 178.838 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.4 ' CD1' ' HG2' ' A' ' 22' ' ' ARG . 52.2 mt -54.96 -30.27 23.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 178.502 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.443 ' HB3' ' HA ' ' A' ' 75' ' ' GLU . 0.0 OUTLIER -57.77 -38.48 75.51 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.065 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.14 -30.92 55.31 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 114.704 -1.135 . . . . 0.0 109.839 178.592 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 67.7 mt -64.74 -49.15 71.94 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 107.987 -1.116 . . . . 0.0 107.987 177.608 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -59.71 -48.73 80.52 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.151 177.633 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 50.5 mtt-85 -64.3 -25.57 68.11 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.962 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -74.63 -48.57 25.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.354 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.5 -29.16 70.2 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.497 179.64 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 31.1 t-20 -61.54 -33.29 73.58 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.024 -0.535 . . . . 0.0 109.912 179.719 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.362 179.423 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' MET . . . . . 0.503 ' HG2' ' O ' ' A' ' 2' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.464 0.252 0 CA-C-O 121.444 0.64 . . . . 0.0 111.985 . . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -120.02 97.58 5.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.276 -179.58 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 34.3 mt -97.04 124.89 50.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.645 179.455 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -134.44 159.9 39.64 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.953 0.406 . . . . 0.0 111.239 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 21.8 p -163.42 145.29 9.65 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.475 -179.766 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 20.8 mmtp -103.41 -6.04 22.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.576 -179.663 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -99.97 -28.21 13.19 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 120.747 0.308 . . . . 0.0 111.209 -179.848 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 37.9 mtm -140.14 -175.52 4.27 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.071 -179.874 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 -111.06 166.93 10.65 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.653 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 5.2 mm -89.97 108.98 20.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 121.101 0.477 . . . . 0.0 111.066 -179.567 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 17.1 p -97.53 154.66 37.88 Favored Pre-proline 0 C--N 1.326 -0.441 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.002 179.721 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_exo -59.54 -17.92 44.16 Favored 'Trans proline' 0 C--N 1.343 0.281 0 C-N-CA 122.466 2.111 . . . . 0.0 112.029 179.339 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.14 -43.48 17.72 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.883 0.373 . . . . 0.0 110.573 179.629 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 27.8 mt -72.6 -27.5 25.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.577 179.086 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 17.4 ttm180 -75.6 -44.77 41.32 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.367 178.732 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -67.84 -39.18 83.87 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.698 179.031 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.539 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 78.2 t60 -60.34 -57.23 13.67 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.843 -0.428 . . . . 0.0 109.843 178.989 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.403 ' O ' ' HG ' ' A' ' 23' ' ' LEU . 35.7 t -61.52 -47.68 92.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 120.778 0.323 . . . . 0.0 110.146 178.477 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.695 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -57.98 -42.34 84.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.958 179.755 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.539 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 0.9 OUTLIER -59.54 -35.21 73.77 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.118 0.485 . . . . 0.0 110.053 179.96 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 25.5 mmm180 -76.24 -26.64 56.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.541 179.415 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.695 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 4.1 mt -68.09 -56.48 8.69 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.01 0.434 . . . . 0.0 110.298 179.484 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.65 -23.58 64.89 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.366 179.736 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.2 tmtm? -78.31 -30.98 48.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.107 0.479 . . . . 0.0 110.344 179.459 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 4.8 mt . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.649 179.556 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo . . . . . 0 C--O 1.232 0.185 0 N-CA-C 113.394 0.498 . . . . 0.0 113.394 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -140.45 126.83 19.98 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.109 179.854 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.428 ' N ' ' CD1' ' A' ' 38' ' ' ILE . 3.0 mp -118.88 136.54 55.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.393 179.587 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 4.9 mt -121.06 148.64 24.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.566 -179.336 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.3 mt -124.24 126.8 46.71 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.624 -0.717 . . . . 0.0 110.643 179.583 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 2.8 m -123.93 -174.26 2.94 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.507 179.898 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.418 ' HG3' ' CD2' ' A' ' 47' ' ' PHE . 11.0 tttm -160.95 140.71 10.79 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.424 0.631 . . . . 0.0 111.396 -179.845 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.405 ' HB3' ' HD2' ' A' ' 44' ' ' PRO . 65.2 mt-10 -131.41 162.15 57.74 Favored Pre-proline 0 C--N 1.322 -0.596 0 CA-C-N 115.026 -0.988 . . . . 0.0 109.305 179.347 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . 0.405 ' HD2' ' HB3' ' A' ' 43' ' ' GLU . 13.4 Cg_endo -56.43 -25.7 59.12 Favored 'Trans proline' 0 N--CA 1.464 -0.229 0 C-N-CA 121.967 1.778 . . . . 0.0 111.95 179.621 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.09 -7.81 56.41 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.121 -0.945 . . . . 0.0 112.796 -179.059 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 150.52 -163.81 29.67 Favored Glycine 0 C--O 1.224 -0.522 0 C-N-CA 120.229 -0.986 . . . . 0.0 112.245 179.869 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.418 ' CD2' ' HG3' ' A' ' 42' ' ' LYS . 18.0 m-85 -108.87 154.85 21.54 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.499 0.666 . . . . 0.0 111.796 179.953 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 53.1 t -128.69 139.39 52.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 114.927 -1.033 . . . . 0.0 111.145 -179.27 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -130.42 123.91 30.89 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.525 179.441 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 28.7 m-20 -118.67 146.25 44.84 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.65 -0.25 . . . . 0.0 110.727 -179.845 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -145.66 140.64 27.45 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.724 -0.39 . . . . 0.0 111.484 179.8 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.0 m -134.59 128.96 34.23 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 179.102 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 21.4 mt -133.75 139.34 48.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 C-N-CA 120.724 -0.391 . . . . 0.0 111.852 -179.277 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -99.86 145.38 27.83 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.85 179.116 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 18.9 p -138.76 158.85 69.35 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.502 179.261 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -73.96 -1.41 10.82 Favored 'Trans proline' 0 N--CA 1.463 -0.31 0 C-N-CA 121.772 1.648 . . . . 0.0 112.729 -179.243 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -126.5 2.39 6.91 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.567 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 162.31 -164.8 35.74 Favored Glycine 0 C--N 1.333 0.363 0 C-N-CA 120.405 -0.902 . . . . 0.0 112.925 -179.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 21.3 t -132.8 148.16 31.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.802 0.334 . . . . 0.0 111.083 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 14.1 mt -121.09 136.01 55.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.428 -179.672 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 21.3 t -140.69 137.29 35.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.657 179.657 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -153.09 155.86 37.6 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.279 0.561 . . . . 0.0 111.892 -179.418 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 88.8 p -143.98 157.41 44.35 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.252 -0.885 . . . . 0.0 111.682 -179.31 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -150.92 99.64 0.2 Allowed Glycine 0 C--N 1.332 0.323 0 CA-C-N 115.833 -0.622 . . . . 0.0 111.559 179.461 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 59.9 mttt -100.83 44.57 1.01 Allowed 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -178.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 12.4 t-80 -75.66 155.31 35.89 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.256 178.709 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -60.46 -26.81 67.06 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.685 0.278 . . . . 0.0 111.29 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -97.09 116.7 29.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.99 0.424 . . . . 0.0 111.329 -179.449 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.7 tmt? -47.57 -46.42 28.01 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.665 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 -66.48 -41.41 89.01 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.31 -179.534 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 35.4 m -65.41 -37.67 87.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.787 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.88 -51.54 67.77 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.822 179.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 7.7 mt -61.64 -42.5 94.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 120.84 0.352 . . . . 0.0 110.319 179.561 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -63.67 -40.2 96.24 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.109 179.253 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -66.47 -42.58 87.32 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.635 179.413 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.55 -60.94 2.63 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 179.3 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 21.9 mt -56.66 -30.29 31.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 178.706 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -59.19 -29.06 67.2 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-O 121.272 0.558 . . . . 0.0 109.974 178.069 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.2 mptt -86.49 -29.32 22.84 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.384 179.184 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 84.1 mt -63.14 -49.76 73.09 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 177.671 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -60.04 -46.44 89.51 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 114.926 -1.033 . . . . 0.0 110.416 177.759 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.51 -33.86 75.74 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.317 -179.506 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 37.0 mt-30 -74.73 -42.36 58.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.836 0.351 . . . . 0.0 110.451 179.765 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.5 mt -65.05 -29.26 70.14 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.61 179.523 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -61.81 -49.26 77.05 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.133 0.492 . . . . 0.0 110.256 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.367 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.974 179.519 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 25.9 p . . . . . 0 N--CA 1.487 1.408 0 CA-C-O 120.766 0.317 . . . . 0.0 111.183 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 8.2 ttp -170.36 102.9 0.27 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.826 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -119.52 122.97 42.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.078 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 36.9 mt -120.68 125.54 74.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.849 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -134.02 160.71 36.92 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.862 0.363 . . . . 0.0 111.119 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 44.8 p -163.43 142.67 8.34 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.637 -179.533 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -102.47 31.25 4.15 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.002 -179.571 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -140.95 -48.0 0.41 Allowed 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.647 179.623 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -119.32 -174.29 2.69 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.638 179.72 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -114.33 167.63 10.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.618 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 5.0 mm -91.2 115.56 30.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.109 0.481 . . . . 0.0 111.085 -179.502 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 15.4 p -99.74 149.33 35.83 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.887 179.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_exo -56.39 -19.64 29.47 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.335 2.023 . . . . 0.0 111.919 179.216 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -77.75 -41.6 37.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.078 0.466 . . . . 0.0 110.284 179.234 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 22.9 mt -73.23 -29.1 27.22 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.367 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.517 178.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 13.3 ttp85 -74.12 -45.74 47.02 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.604 -0.726 . . . . 0.0 109.227 178.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 33.8 tt0 -67.46 -37.35 82.8 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.503 178.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.511 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 72.5 t60 -59.2 -62.49 1.85 Allowed 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 178.872 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 22.2 t -60.65 -46.56 95.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.609 -0.268 . . . . 0.0 110.536 178.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.669 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -57.06 -43.94 82.53 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.846 179.746 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.511 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 1.1 p30 -59.66 -33.34 71.42 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.95 0.405 . . . . 0.0 110.645 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 10.3 mmt180 -74.67 -28.16 60.72 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.058 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.669 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 2.4 mt -67.53 -52.77 34.94 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.151 0.5 . . . . 0.0 110.293 179.453 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.48 -25.45 66.06 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.217 179.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.94 -28.28 43.72 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.934 179.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.449 ' CD2' ' CD1' ' A' ' 29' ' ' TRP . 5.8 mt -76.73 59.68 1.59 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.0 -179.816 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.04 -52.49 16.7 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.859 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.423 ' HD2' ' CE2' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -52.25 -26.1 11.02 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.473 0.654 . . . . 0.0 110.917 179.691 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.449 ' CD1' ' CD2' ' A' ' 26' ' ' LEU . 71.4 m95 -87.9 -25.63 23.15 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.943 -1.026 . . . . 0.0 111.794 -179.359 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.4 114.39 1.64 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.87 179.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.501 HG21 ' CG ' ' A' ' 32' ' ' HIS . 15.4 t -159.4 -39.69 0.06 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.331 -179.705 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . 0.501 ' CG ' HG21 ' A' ' 31' ' ' THR . 1.0 OUTLIER -143.41 -120.17 0.09 Allowed 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 116.748 -0.206 . . . . 0.0 110.892 179.556 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.9 mp 61.06 116.27 0.02 OUTLIER 'General case' 0 N--CA 1.46 0.071 0 CA-C-O 120.768 0.318 . . . . 0.0 110.542 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.1 mt -127.06 104.48 12.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.813 0.34 . . . . 0.0 111.538 -179.581 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 61.26 74.46 0.51 Allowed Pre-proline 0 C--N 1.328 -0.349 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.432 179.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_endo -76.93 155.04 34.02 Favored 'Trans proline' 0 C--N 1.343 0.269 0 C-N-CA 122.63 2.22 . . . . 0.0 111.958 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -136.84 130.05 31.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.233 -179.66 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 3.4 mp -121.46 134.6 64.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.855 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 4.1 mp -116.95 146.04 21.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.999 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.8 mt -122.31 128.32 50.91 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.054 0.454 . . . . 0.0 111.023 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 5.3 m -123.99 -173.55 2.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.301 179.6 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.425 ' HG3' ' CD2' ' A' ' 47' ' ' PHE . 3.0 tttp -158.58 141.29 14.46 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.372 0.606 . . . . 0.0 111.43 -179.678 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -131.82 156.37 80.2 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-N 115.075 -0.966 . . . . 0.0 109.146 179.232 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_exo -51.73 -24.42 17.92 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 121.881 1.721 . . . . 0.0 112.382 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.72 -6.84 55.66 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.47 -0.786 . . . . 0.0 112.808 -179.148 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 149.68 -164.15 29.44 Favored Glycine 0 C--O 1.224 -0.501 0 C-N-CA 120.153 -1.022 . . . . 0.0 112.161 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.425 ' CD2' ' HG3' ' A' ' 42' ' ' LYS . 18.0 m-85 -108.19 152.63 24.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.544 0.688 . . . . 0.0 112.015 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 53.2 t -127.55 142.01 44.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 114.753 -1.112 . . . . 0.0 110.96 -179.23 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -132.45 124.88 29.45 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.986 179.666 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -117.7 149.5 40.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.436 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . 0.46 ' N ' HD12 ' A' ' 76' ' ' LEU . . . -146.02 142.06 28.26 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.905 0.383 . . . . 0.0 111.798 -179.728 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 4.4 m -134.35 134.04 41.33 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.278 179.651 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 3.4 mm -132.54 133.29 59.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.979 0.418 . . . . 0.0 111.16 -179.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 13.5 m-20 -102.98 130.86 50.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.427 179.02 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 7.3 p -128.6 165.74 29.38 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.749 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_exo -69.87 -8.98 24.96 Favored 'Trans proline' 0 CA--C 1.529 0.247 0 C-N-CA 122.703 2.269 . . . . 0.0 112.55 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -123.08 22.91 9.41 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 111.694 0.257 . . . . 0.0 111.694 -179.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 132.77 -167.42 23.23 Favored Glycine 0 C--N 1.331 0.255 0 C-N-CA 120.441 -0.885 . . . . 0.0 112.938 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 14.9 t -136.43 143.48 35.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.813 0.339 . . . . 0.0 110.943 -179.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.9 mt -115.55 155.72 27.05 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.981 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 21.4 t -140.19 148.03 22.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.312 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -153.73 146.52 24.33 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.045 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -146.16 155.72 42.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.744 -179.442 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -142.85 154.49 25.34 Favored Glycine 0 N--CA 1.452 -0.277 0 N-CA-C 111.181 -0.768 . . . . 0.0 111.181 179.128 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 19.6 mttt -147.59 42.92 1.08 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 117.239 0.519 . . . . 0.0 112.018 -179.336 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.407 ' ND1' ' CG2' ' A' ' 71' ' ' THR . 12.8 t-80 -76.06 154.96 35.25 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.303 178.935 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -60.96 -26.14 67.32 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.727 0.299 . . . . 0.0 111.165 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -98.5 121.94 41.07 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.044 0.45 . . . . 0.0 111.433 -179.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.9 ttt -48.33 -49.18 35.17 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.802 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 42.2 m-85 -65.75 -37.6 86.83 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.44 -179.242 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.407 ' CG2' ' ND1' ' A' ' 66' ' ' HIS . 93.6 m -64.85 -40.42 95.14 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.792 0.329 . . . . 0.0 110.613 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.82 -48.28 81.31 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.624 179.552 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 10.3 mt -60.52 -43.0 93.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.839 0.352 . . . . 0.0 110.181 179.384 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -65.21 -39.65 93.08 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.212 179.099 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -66.64 -45.61 78.46 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.728 179.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.46 HD12 ' N ' ' A' ' 51' ' ' ALA . 0.2 OUTLIER -53.42 -61.09 2.52 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.554 -0.294 . . . . 0.0 110.284 179.479 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 62.4 mt -55.37 -28.19 21.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 C-N-CA 120.899 -0.32 . . . . 0.0 110.201 179.086 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -58.99 -38.0 78.15 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 177.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.25 -30.22 63.31 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 114.755 -1.112 . . . . 0.0 109.849 178.69 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 84.1 mt -63.31 -48.63 77.27 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 177.511 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.418 ' HG2' ' CZ2' ' A' ' 29' ' ' TRP . 6.4 tt0 -61.69 -49.44 76.46 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 114.625 -1.171 . . . . 0.0 110.52 177.801 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.07 -27.27 69.28 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.157 -179.77 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -75.38 -44.49 44.57 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.932 0.396 . . . . 0.0 110.686 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.427 ' HB2' ' CE3' ' A' ' 29' ' ' TRP . 3.5 mt -64.2 -26.46 68.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.71 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -63.6 -41.48 98.32 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.192 179.653 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 17.5 mmtt -74.21 -18.98 60.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.285 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.408 ' O ' ' CD2' ' A' ' 89' ' ' HIS . 20.6 mt -67.99 -38.9 83.22 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.945 0.402 . . . . 0.0 110.443 179.842 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 -78.4 -21.1 49.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.842 179.458 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.408 ' CD2' ' O ' ' A' ' 87' ' ' LEU . 22.9 m-70 55.29 -162.64 0.15 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.019 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -168.71 -42.54 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.835 179.828 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 69.56 -175.31 33.83 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.621 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -109.03 -27.42 9.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.781 0.324 . . . . 0.0 110.972 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . 65.64 125.87 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.109 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -154.21 119.46 5.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.819 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -87.72 -79.43 0.29 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.96 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -179.14 -168.73 0.13 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.089 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -93.24 -31.11 14.86 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.061 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 1.6 m -125.1 -65.39 1.03 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.837 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' SER . . . . . 0.431 ' O ' ' CG2' ' A' ' 100' ' ' VAL . 29.2 t -176.86 -43.88 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.866 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.431 ' CG2' ' O ' ' A' ' 99' ' ' SER . 24.2 m 45.63 -172.37 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.674 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -177.32 114.6 0.09 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.86 -179.848 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 29.9 m-20 -149.35 122.15 8.7 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.985 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -175.72 131.99 0.27 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.092 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -141.62 143.13 33.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.897 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 19.7 m-85 -109.64 -29.77 8.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.933 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 8.7 m -56.8 -31.38 35.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.204 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.4 tm-20 -144.1 87.53 1.9 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.837 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -166.31 35.6 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.889 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 13.9 m -154.99 -46.08 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.083 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -59.46 -57.95 10.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.863 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -90.92 -32.39 16.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.857 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 . . . . . 0 C--O 1.25 1.089 0 CA-C-O 118.201 -0.904 . . . . 0.0 110.944 179.977 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.486 1.336 0 CA-C-O 120.757 0.313 . . . . 0.0 111.168 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.7 tmt? 57.25 86.3 0.07 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.906 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.401 ' OD1' ' CE1' ' A' ' 37' ' ' HIS . 3.3 t-20 -127.76 109.38 11.59 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.278 -179.631 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 7.7 pt -118.19 128.66 75.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.702 179.561 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -134.0 165.85 24.07 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.229 -179.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 21.7 p -163.51 144.47 9.12 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.24 -179.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.77 -2.67 27.66 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.67 -179.54 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -98.85 -29.44 12.96 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 120.705 0.288 . . . . 0.0 111.041 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 34.6 mtm -143.41 178.79 7.51 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.032 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -98.74 163.88 12.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.69 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 5.0 mm -90.67 116.68 32.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.052 0.453 . . . . 0.0 111.05 -179.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 15.1 p -100.52 158.47 31.86 Favored Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.959 179.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_exo -63.32 -14.65 43.41 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.519 2.146 . . . . 0.0 111.911 179.091 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -84.49 -41.24 16.76 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-O 121.012 0.434 . . . . 0.0 110.434 179.507 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 34.6 mt -72.95 -30.5 32.44 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.299 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.284 178.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.444 ' O ' ' CB ' ' A' ' 20' ' ' ALA . 47.3 mtp180 -71.67 -47.11 56.45 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.502 178.551 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 19.4 tt0 -67.18 -36.07 80.99 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.557 178.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.471 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 56.6 t60 -60.13 -64.56 0.91 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.951 0.405 . . . . 0.0 110.025 178.933 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 23.3 t -61.34 -47.1 95.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.9 179.128 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.653 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -56.44 -47.06 79.9 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 111.751 0.278 . . . . 0.0 111.751 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.471 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 3.2 p30 -59.83 -29.1 68.04 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.705 -0.398 . . . . 0.0 110.447 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 17.2 mmm180 -75.7 -29.85 59.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.591 179.41 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.653 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 1.3 mt -68.17 -50.62 53.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.942 0.401 . . . . 0.0 110.272 179.183 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.33 -24.32 63.25 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.803 179.467 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 29.4 tttt -78.1 -32.49 50.58 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.409 179.238 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -80.69 56.11 2.56 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.757 179.542 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -111.66 -7.8 14.24 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.496 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.72 -13.74 61.7 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.803 0.335 . . . . 0.0 111.389 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.436 ' CE3' ' HB3' ' A' ' 84' ' ' LEU . 61.7 m95 -85.04 168.58 14.78 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.145 -179.73 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -96.07 -3.05 45.45 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.332 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 4.7 t -77.52 128.84 34.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.869 0.366 . . . . 0.0 110.526 179.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 64.5 m-70 -81.9 -39.93 23.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.967 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.6 mp 62.44 135.5 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.276 -179.711 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 4.8 mt -127.56 106.65 15.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-O 121.403 0.621 . . . . 0.0 112.147 -179.235 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 34.1 m-80 53.87 75.61 0.61 Allowed Pre-proline 0 C--N 1.326 -0.431 0 CA-C-N 114.903 -1.044 . . . . 0.0 112.328 178.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -79.3 154.43 24.78 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.684 2.256 . . . . 0.0 111.326 178.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . 0.401 ' CE1' ' OD1' ' A' ' 3' ' ' ASN . 1.6 t-160 -134.0 128.43 34.36 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.123 0.487 . . . . 0.0 111.612 -179.397 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.406 ' N ' ' CD1' ' A' ' 38' ' ' ILE . 3.4 mp -120.73 135.63 60.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.594 179.491 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 26.5 mt -115.78 146.44 20.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.937 0.399 . . . . 0.0 111.254 -179.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.9 mt -119.86 128.68 53.89 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.808 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 9.2 m -125.5 -170.46 2.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.733 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.468 ' HA ' ' HA ' ' A' ' 47' ' ' PHE . 3.6 ttpm? -173.29 145.96 1.35 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.186 0.517 . . . . 0.0 110.762 -179.812 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.405 ' N ' ' HG2' ' A' ' 42' ' ' LYS . 5.5 mt-10 -131.0 170.47 11.15 Favored Pre-proline 0 C--N 1.324 -0.504 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.213 179.043 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_exo -51.62 -19.34 7.31 Favored 'Trans proline' 0 N--CA 1.463 -0.282 0 C-N-CA 121.786 1.658 . . . . 0.0 112.354 -179.332 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.01 -78.71 0.27 Allowed 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.905 179.094 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -141.16 -154.6 6.24 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.665 -179.281 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.468 ' HA ' ' HA ' ' A' ' 42' ' ' LYS . 20.1 m-85 -109.6 151.33 26.96 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 121.623 0.725 . . . . 0.0 112.726 -179.437 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.42 ' HA ' ' O ' ' A' ' 64' ' ' GLY . 54.9 t -124.61 142.93 39.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 114.511 -1.222 . . . . 0.0 110.48 -179.888 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -132.9 126.08 31.33 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.238 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -118.92 150.28 40.17 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.583 179.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . 0.446 ' N ' HD13 ' A' ' 76' ' ' LEU . . . -146.8 141.14 26.37 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.845 0.355 . . . . 0.0 111.657 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.2 m -135.79 130.83 34.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.024 179.45 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 13.4 mt -133.02 138.03 52.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 121.102 0.477 . . . . 0.0 111.785 -179.69 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 19.9 m-20 -102.05 119.25 38.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.723 179.362 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 10.6 p -112.23 156.3 42.24 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.453 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -63.48 -14.21 41.02 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 122.484 2.123 . . . . 0.0 112.619 -179.776 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 9.1 m120 -119.69 23.4 11.16 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.628 -0.26 . . . . 0.0 111.538 -179.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 137.07 -166.95 24.82 Favored Glycine 0 N--CA 1.453 -0.175 0 C-N-CA 120.488 -0.863 . . . . 0.0 112.902 179.791 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 15.0 t -135.91 142.91 37.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.828 0.347 . . . . 0.0 111.037 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 37.0 mt -116.98 152.75 33.94 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.11 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 21.5 t -139.91 146.78 24.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.067 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -153.58 150.64 28.88 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.074 0.464 . . . . 0.0 111.205 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 94.3 p -145.69 156.17 43.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.73 -179.212 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.42 ' O ' ' HA ' ' A' ' 48' ' ' VAL . . . -144.39 146.91 17.83 Favored Glycine 0 C--N 1.331 0.302 0 N-CA-C 111.06 -0.816 . . . . 0.0 111.06 179.034 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 8.1 mttt -141.21 43.8 1.78 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 117.212 0.506 . . . . 0.0 112.056 -178.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.422 ' CG ' HG23 ' A' ' 71' ' ' THR . 12.9 t-80 -76.8 155.3 33.17 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.794 0.33 . . . . 0.0 110.436 178.887 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -61.13 -26.66 67.84 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.323 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -97.93 123.62 42.0 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.027 0.441 . . . . 0.0 111.45 -179.34 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.3 ttt -48.06 -50.15 29.0 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.774 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 72.6 m-85 -66.32 -38.29 87.35 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.672 -179.037 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.422 HG23 ' CG ' ' A' ' 66' ' ' HIS . 87.2 m -64.51 -42.57 95.73 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.698 0.285 . . . . 0.0 110.82 -179.775 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.09 -47.42 86.38 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.516 179.575 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 13.0 mt -60.13 -45.39 95.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 120.959 0.409 . . . . 0.0 110.311 179.459 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -64.62 -39.0 92.92 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.364 179.475 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -65.24 -43.59 90.9 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.412 179.46 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.446 HD13 ' N ' ' A' ' 51' ' ' ALA . 0.2 OUTLIER -54.35 -57.34 11.64 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 179.065 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 8.7 mt -57.53 -30.58 36.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 N-CA-C 110.104 -0.332 . . . . 0.0 110.104 178.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -57.97 -37.78 74.82 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.561 0.696 . . . . 0.0 109.38 178.391 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -75.11 -28.9 60.41 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.708 -1.133 . . . . 0.0 109.935 178.873 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 99.3 mt -62.74 -49.45 74.98 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 177.424 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -62.29 -43.87 97.83 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 114.53 -1.214 . . . . 0.0 110.511 177.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 1.4 ptt180 -62.4 -34.61 77.07 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.638 -179.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 38.5 mt-30 -74.52 -39.22 62.51 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.478 179.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.436 ' HB3' ' CE3' ' A' ' 29' ' ' TRP . 19.3 mt -65.78 -26.01 67.51 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.846 179.581 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -63.93 -42.39 97.36 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.583 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.441 ' HA ' ' CD2' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -73.92 -22.73 59.58 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.051 179.882 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 4.2 tt -70.96 -14.37 62.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.955 -179.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . 0.405 ' CG ' ' N ' ' A' ' 89' ' ' HIS . 2.1 pt20 -75.83 -47.34 26.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.067 0.46 . . . . 0.0 111.541 -179.278 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.441 ' CD2' ' HA ' ' A' ' 86' ' ' LYS . 6.6 p80 -87.26 -170.73 3.17 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.128 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.421 ' CB ' ' O ' ' A' ' 89' ' ' HIS . 0.6 OUTLIER 83.6 83.83 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.899 179.811 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 69.04 -169.81 42.19 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.528 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -146.99 125.97 12.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.767 0.318 . . . . 0.0 110.915 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.1 174.67 0.84 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.201 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 17.7 ttm-85 -150.26 -47.8 0.13 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.813 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.44 31.67 3.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.778 179.895 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -72.58 -31.08 64.93 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.228 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -62.79 169.22 3.31 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.184 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 34.2 p -87.82 141.67 28.41 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.929 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 66.5 m -109.93 175.42 5.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.909 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 27.1 m -104.04 -29.62 2.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.132 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.91 176.28 0.32 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.887 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 11.5 p30 -157.27 38.53 0.29 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.8 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.77 -19.79 65.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.359 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 22.8 p30 -53.34 168.97 0.13 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.902 0.382 . . . . 0.0 111.16 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 50.7 p90 -59.44 -178.47 0.06 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.979 -179.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 21.5 t -124.54 127.5 72.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.02 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -70.23 136.08 49.61 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.899 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -104.8 159.68 15.6 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.991 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 26.9 m -98.45 31.13 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.117 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -132.76 31.55 3.94 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.917 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -119.84 78.6 1.35 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.892 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 24.0 tt0 . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.268 -0.872 . . . . 0.0 110.921 -179.995 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 3.2 p . . . . . 0 N--CA 1.487 1.409 0 CA-C-O 120.866 0.365 . . . . 0.0 111.229 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.9 tmm? -59.14 118.84 6.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.862 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -121.01 111.13 17.09 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.142 -179.819 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.42 HD12 HG22 ' A' ' 4' ' ' ILE . 45.8 mt -110.68 125.6 67.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.848 179.65 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.8 p -134.04 160.58 37.31 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.123 179.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 39.3 p -163.5 140.54 7.25 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.462 -179.557 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.1 mttp -101.13 33.62 2.8 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.032 -179.615 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -140.62 -50.39 0.45 Allowed 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.53 179.584 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 7.7 mtm -120.6 -174.45 2.81 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.606 179.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -111.62 171.84 7.25 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.766 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.8 mm -90.93 112.6 25.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 121.063 0.459 . . . . 0.0 111.054 -179.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 15.9 p -98.69 153.05 38.09 Favored Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.886 179.608 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_exo -58.61 -17.1 33.38 Favored 'Trans proline' 0 C--N 1.345 0.342 0 C-N-CA 122.379 2.052 . . . . 0.0 111.879 179.139 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.34 -42.53 20.4 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-O 121.022 0.439 . . . . 0.0 110.44 179.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 36.1 mt -72.81 -28.34 26.97 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 CA-C-N 115.747 -0.661 . . . . 0.0 109.376 178.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 1.8 mmm180 -75.2 -46.27 35.05 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.627 178.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 51.9 tp60 -67.72 -38.53 83.73 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.714 179.096 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.502 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 81.2 t60 -60.11 -61.43 2.61 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 179.049 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.422 ' O ' ' HG ' ' A' ' 23' ' ' LEU . 29.7 t -60.75 -47.01 95.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 116.622 -0.263 . . . . 0.0 110.552 178.909 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.67 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -57.52 -42.64 83.21 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 111.753 0.279 . . . . 0.0 111.753 179.702 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.502 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 1.0 OUTLIER -59.96 -33.28 71.71 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 120.64 -0.424 . . . . 0.0 110.287 179.916 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 27.2 mmt180 -75.02 -28.03 60.32 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.056 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.67 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 3.6 mt -68.85 -54.05 17.92 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.004 0.43 . . . . 0.0 110.408 179.397 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.62 -24.31 63.71 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.813 -0.631 . . . . 0.0 111.188 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -79.5 -30.88 42.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.112 0.482 . . . . 0.0 110.286 179.41 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.538 ' HB3' ' HB2' ' A' ' 29' ' ' TRP . 37.2 mt -79.77 58.43 2.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.793 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -56.27 -75.3 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.519 -179.563 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.446 ' HD2' ' CD2' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -51.44 -27.3 9.87 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.182 0.515 . . . . 0.0 111.308 -179.513 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.538 ' HB2' ' HB3' ' A' ' 26' ' ' LEU . 13.5 m95 -90.72 36.05 0.9 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.475 -179.922 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 8.0 mt-30 -139.32 59.95 1.59 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.014 0.435 . . . . 0.0 110.355 179.685 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -78.29 90.99 4.37 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.051 -179.684 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 70.5 m-70 62.81 -85.23 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.584 179.647 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 62.71 143.93 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 -179.318 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 1.8 mm -135.5 110.07 11.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 121.604 0.716 . . . . 0.0 112.15 -179.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 25.4 m-20 52.76 77.61 0.44 Allowed Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 114.69 -1.141 . . . . 0.0 112.61 178.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_endo -80.91 130.67 7.62 Favored 'Trans proline' 0 N--CA 1.462 -0.375 0 C-N-CA 122.587 2.191 . . . . 0.0 111.279 178.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -109.7 132.46 54.12 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.119 0.485 . . . . 0.0 112.153 -178.904 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 10.8 mm -121.51 133.3 68.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.263 179.232 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 3.8 mt -123.77 139.2 51.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 120.981 0.419 . . . . 0.0 111.5 -179.375 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -116.93 128.1 54.88 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.727 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.2 m -124.2 -175.2 3.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.6 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.431 ' HG3' ' CD2' ' A' ' 47' ' ' PHE . 13.5 tttm -158.4 140.15 13.73 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.365 0.602 . . . . 0.0 111.157 -179.558 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 60.1 mt-10 -131.5 156.11 80.56 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 115.105 -0.952 . . . . 0.0 109.313 179.19 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_exo -51.5 -24.67 17.3 Favored 'Trans proline' 0 N--CA 1.464 -0.24 0 C-N-CA 121.906 1.737 . . . . 0.0 112.435 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -89.61 -6.69 56.01 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.437 -0.801 . . . . 0.0 112.749 -179.122 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 150.36 -163.9 29.64 Favored Glycine 0 C--O 1.225 -0.443 0 C-N-CA 120.227 -0.987 . . . . 0.0 112.275 179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.431 ' CD2' ' HG3' ' A' ' 42' ' ' LYS . 18.9 m-85 -109.07 154.43 22.26 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.559 0.695 . . . . 0.0 111.987 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 68.0 t -127.94 139.57 51.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 114.787 -1.097 . . . . 0.0 110.941 -179.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -131.14 124.06 29.89 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.597 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -120.08 147.03 45.36 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.658 0.266 . . . . 0.0 110.986 -179.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . 0.416 ' N ' HD11 ' A' ' 76' ' ' LEU . . . -144.35 140.92 29.39 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.829 0.347 . . . . 0.0 111.387 179.738 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.0 m -136.33 131.3 34.13 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.253 179.469 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 15.3 mt -132.45 135.59 57.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 120.865 0.364 . . . . 0.0 111.252 -179.604 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -104.11 121.16 42.65 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.648 179.372 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 7.6 p -116.29 155.03 48.83 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.622 179.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_exo -65.33 -11.92 32.44 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.515 2.143 . . . . 0.0 112.528 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 8.5 m-80 -112.37 -4.3 14.31 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 111.732 0.271 . . . . 0.0 111.732 -179.697 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 162.32 -166.98 36.72 Favored Glycine 0 C--N 1.331 0.27 0 C-N-CA 120.388 -0.91 . . . . 0.0 112.82 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 34.8 t -129.98 140.36 49.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 120.835 0.35 . . . . 0.0 111.134 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -118.34 142.58 47.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.818 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.433 ' O ' ' NE2' ' A' ' 83' ' ' GLN . 11.1 p -140.67 146.61 23.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.935 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -155.85 152.68 28.66 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.265 0.555 . . . . 0.0 111.698 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 67.1 m -143.23 160.46 40.43 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.709 -179.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -155.18 105.77 0.28 Allowed Glycine 0 CA--C 1.519 0.289 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.566 179.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.1 mtmp? -107.73 44.47 1.09 Allowed 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.1 0.408 . . . . 0.0 112.1 -178.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 14.6 t-80 -75.72 156.33 34.78 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.578 -0.283 . . . . 0.0 110.415 178.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -60.07 -27.28 66.84 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.673 0.273 . . . . 0.0 111.199 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -98.33 120.46 38.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.944 0.402 . . . . 0.0 111.475 -179.438 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 13.3 ttt -48.2 -46.72 35.4 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.591 179.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 44.3 m-85 -66.47 -40.97 89.63 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.293 -179.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 86.8 m -65.26 -38.68 91.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.746 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.13 -50.71 70.8 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.8 179.607 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 7.0 mt -61.53 -43.78 97.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.788 0.327 . . . . 0.0 110.352 179.543 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -63.52 -40.25 96.55 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.246 179.339 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.12 -42.68 88.84 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.381 179.367 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.416 HD11 ' N ' ' A' ' 51' ' ' ALA . 0.2 OUTLIER -52.19 -62.0 1.91 Allowed 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 109.881 -0.415 . . . . 0.0 109.881 179.036 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 46.3 mt -55.05 -30.29 23.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 178.71 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -59.55 -29.58 68.02 Favored 'General case' 0 N--CA 1.442 -0.856 0 CA-C-O 121.22 0.533 . . . . 0.0 110.298 178.188 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.98 -28.34 22.73 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.354 179.155 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 97.3 mt -63.7 -50.31 69.69 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 177.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -60.0 -50.67 72.83 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 114.907 -1.042 . . . . 0.0 111.057 177.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.52 -32.63 73.6 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.898 -179.349 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.433 ' NE2' ' O ' ' A' ' 61' ' ' VAL . 41.4 mt-30 -74.2 -42.54 59.63 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.619 179.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.6 mt -65.55 -29.2 69.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.462 179.464 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -63.25 -28.25 69.9 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.568 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.442 ' HA ' ' CD2' ' A' ' 89' ' ' HIS . 25.9 mmtt -72.38 -17.52 61.81 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.249 -179.818 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 61.3 mt -69.64 -16.68 63.42 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.327 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 -76.26 -22.9 54.58 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.906 0.384 . . . . 0.0 111.272 -179.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.442 ' CD2' ' HA ' ' A' ' 86' ' ' LYS . 16.1 m-70 -85.79 -38.69 17.91 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.764 179.82 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.96 -21.05 63.29 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.125 -179.768 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -77.77 59.21 3.82 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.589 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -122.11 -38.83 2.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.941 0.401 . . . . 0.0 110.9 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -131.74 -59.35 0.95 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.0 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 4.7 ttp180 62.78 124.55 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.982 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 10.2 mtp180 -159.36 -46.3 0.05 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.902 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . 59.53 77.72 0.3 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.058 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -110.47 108.14 18.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.088 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 25.6 p -109.33 164.06 12.82 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.883 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.5 m -62.5 178.84 0.38 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.827 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 23.0 m -116.27 145.16 22.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.143 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -112.59 123.91 51.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.937 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -177.88 75.5 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.854 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -160.65 137.81 9.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.167 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 62.73 17.22 9.63 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.351 179.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 1.7 t80 48.08 94.5 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.829 0.347 . . . . 0.0 111.29 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 27.4 t -71.99 107.16 2.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.004 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -139.76 138.69 36.12 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.801 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 59.22 91.55 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.926 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 15.3 m -143.61 128.15 14.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.141 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -99.39 72.74 1.83 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.807 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 14.9 tt0 -163.84 113.36 1.25 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.896 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 . . . . . 0 C--O 1.248 1.006 0 CA-C-O 118.239 -0.886 . . . . 0.0 110.96 -179.983 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 11.6 t . . . . . 0 N--CA 1.487 1.377 0 CA-C-O 120.714 0.292 . . . . 0.0 111.307 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' MET . . . . . 0.426 ' CG ' ' CD1' ' A' ' 23' ' ' LEU . 0.0 OUTLIER -103.9 -177.97 3.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.978 179.984 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -122.38 112.98 18.75 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.392 -179.7 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 34.8 mt -109.97 126.75 67.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.539 179.419 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -134.38 162.25 32.75 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.862 0.363 . . . . 0.0 111.133 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 38.9 p -164.36 136.27 4.63 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.548 -179.739 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.6 mtpp -102.33 18.68 20.4 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.195 -179.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -141.72 20.61 2.17 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 120.881 0.372 . . . . 0.0 110.927 179.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 177.31 -177.99 0.18 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.545 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -117.84 160.22 21.77 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.855 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 3.4 mm -92.28 118.54 38.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.012 -179.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 13.7 p -100.11 149.87 36.39 Favored Pre-proline 0 C--N 1.326 -0.424 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.701 179.528 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -56.23 -18.99 25.84 Favored 'Trans proline' 0 C--N 1.343 0.288 0 C-N-CA 122.4 2.067 . . . . 0.0 112.131 179.405 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.78 -39.93 25.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.069 0.461 . . . . 0.0 110.443 179.485 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 21.5 mt -72.93 -31.69 36.86 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.216 178.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.422 ' O ' ' CB ' ' A' ' 20' ' ' ALA . 0.2 OUTLIER -72.14 -47.37 51.49 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.537 178.854 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -66.94 -35.6 80.35 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.535 178.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.445 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 79.4 t60 -58.65 -65.27 0.69 Allowed 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 178.831 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 20.3 t -61.2 -46.17 97.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.819 178.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.597 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -55.37 -49.85 71.23 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 111.782 0.29 . . . . 0.0 111.782 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.445 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 3.2 p30 -58.58 -29.16 66.21 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.815 0.34 . . . . 0.0 110.709 -179.709 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 41.9 mmt180 -75.14 -28.66 60.24 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.575 179.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.597 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 1.1 mt -69.41 -49.6 53.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.985 0.421 . . . . 0.0 110.529 179.148 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.35 -28.03 66.47 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.168 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.1 ttmm -79.53 -32.73 42.3 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.96 0.41 . . . . 0.0 110.587 179.356 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.528 ' HB3' ' HB2' ' A' ' 29' ' ' TRP . 5.4 mt -81.0 57.36 3.07 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.782 179.814 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -64.4 -63.73 1.06 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.2 -179.715 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.432 ' HD2' ' CZ3' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -48.31 -27.4 2.51 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.395 0.617 . . . . 0.0 111.068 179.997 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.528 ' HB2' ' HB3' ' A' ' 26' ' ' LEU . 53.9 m95 -86.0 -35.81 20.15 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 114.961 -1.018 . . . . 0.0 111.938 -179.258 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . 0.423 ' O ' ' N ' ' A' ' 32' ' ' HIS . 0.0 OUTLIER -55.21 -56.65 17.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.831 0.348 . . . . 0.0 110.565 179.805 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER 38.78 -90.56 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.769 -0.65 . . . . 0.0 112.044 179.738 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . 0.423 ' N ' ' O ' ' A' ' 30' ' ' GLN . 35.2 m-70 -129.38 117.63 20.9 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.047 0.451 . . . . 0.0 111.467 -179.589 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 24.3 mt -147.05 147.91 31.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.923 179.319 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 4.1 mp -144.87 119.16 3.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-O 121.683 0.754 . . . . 0.0 112.177 -179.511 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 11.9 m120 70.69 55.23 0.44 Allowed Pre-proline 0 C--N 1.327 -0.412 0 CA-C-N 114.502 -1.226 . . . . 0.0 111.938 178.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -65.09 129.26 22.55 Favored 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 122.186 1.924 . . . . 0.0 111.947 -179.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -139.44 127.7 22.65 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.934 0.397 . . . . 0.0 111.687 -179.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.408 ' N ' ' CD1' ' A' ' 38' ' ' ILE . 3.3 mp -120.86 136.57 57.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.627 179.573 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 23.1 mt -116.91 146.13 21.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.075 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.3 mt -123.26 128.18 49.62 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.759 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 20.1 m -125.21 -172.45 2.59 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.388 179.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.436 ' HG3' ' CE2' ' A' ' 47' ' ' PHE . 0.0 OUTLIER -162.55 145.28 11.05 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.367 0.603 . . . . 0.0 111.249 -179.878 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -133.57 169.89 12.78 Favored Pre-proline 0 C--N 1.322 -0.624 0 CA-C-N 115.052 -0.976 . . . . 0.0 109.322 179.339 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -61.71 -25.81 79.22 Favored 'Trans proline' 0 N--CA 1.464 -0.253 0 C-N-CA 121.91 1.74 . . . . 0.0 112.088 179.633 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -90.45 -8.39 50.65 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.273 -0.876 . . . . 0.0 113.044 -178.895 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 152.47 -169.06 31.62 Favored Glycine 0 C--O 1.225 -0.46 0 C-N-CA 120.065 -1.064 . . . . 0.0 112.515 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.445 ' N ' ' CD1' ' A' ' 47' ' ' PHE . 10.7 m-85 -106.02 153.95 21.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.597 0.713 . . . . 0.0 112.162 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 54.3 t -127.58 141.39 46.5 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 CA-C-N 114.665 -1.152 . . . . 0.0 110.97 -179.322 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.432 ' O ' ' HA ' ' A' ' 63' ' ' SER . . . -133.05 123.2 25.34 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.549 179.642 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -119.56 150.77 39.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.648 0.261 . . . . 0.0 110.854 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -147.44 139.73 24.51 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.75 0.309 . . . . 0.0 111.151 179.589 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 4.5 m -135.14 133.27 39.01 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.328 -0.397 . . . . 0.0 110.171 179.583 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 18.5 mt -134.52 135.6 53.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.039 0.447 . . . . 0.0 111.387 -179.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -104.28 119.66 39.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.458 179.137 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 7.2 p -112.51 167.07 9.73 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.975 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_exo -71.37 -7.84 22.13 Favored 'Trans proline' 0 C--N 1.343 0.279 0 C-N-CA 122.899 2.4 . . . . 0.0 112.636 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -120.19 -4.41 10.0 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 111.776 0.287 . . . . 0.0 111.776 -179.589 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 160.61 -169.76 36.41 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.44 -0.886 . . . . 0.0 112.74 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 15.9 t -130.07 143.3 41.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.781 0.324 . . . . 0.0 111.119 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.4 mt -118.35 151.37 37.86 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.044 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.4 ' O ' ' NE2' ' A' ' 83' ' ' GLN . 21.4 t -140.57 143.55 28.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.887 179.882 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -150.95 151.7 32.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.037 0.446 . . . . 0.0 111.603 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' SER . . . . . 0.432 ' HA ' ' O ' ' A' ' 49' ' ' ALA . 2.0 t -145.09 155.74 43.51 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.722 -179.423 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -149.73 102.07 0.23 Allowed Glycine 0 C--N 1.331 0.279 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.609 179.413 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 5.5 mtmp? -103.84 44.55 1.01 Allowed 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -178.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 12.2 t-80 -75.55 155.64 35.83 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 110.131 -0.322 . . . . 0.0 110.131 178.426 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -60.95 -26.73 67.74 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.731 0.3 . . . . 0.0 111.425 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -97.29 122.17 40.02 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.024 0.44 . . . . 0.0 111.426 -179.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 2.5 ttt -47.98 -51.01 25.47 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.891 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 15.9 m-85 -65.89 -37.6 86.55 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.567 -179.122 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 87.5 m -64.7 -41.16 96.21 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.791 0.329 . . . . 0.0 110.649 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.48 -48.2 82.21 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.439 179.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 15.7 mt -60.3 -45.47 96.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.869 0.366 . . . . 0.0 110.387 179.635 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -64.29 -39.6 94.25 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.5 179.449 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -65.28 -45.07 85.97 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.449 179.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -52.57 -58.2 7.53 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 179.129 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 34.7 mt -57.2 -32.45 40.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 178.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -59.0 -28.61 66.54 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-O 121.148 0.499 . . . . 0.0 110.174 178.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.17 -26.84 24.92 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.118 179.151 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 64.9 mt -62.86 -50.01 72.62 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 107.931 -1.137 . . . . 0.0 107.931 177.424 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.418 ' HG3' ' CD1' ' A' ' 29' ' ' TRP . 5.8 tt0 -60.87 -44.67 96.75 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 114.598 -1.183 . . . . 0.0 110.571 177.711 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 1.1 ptt180 -62.85 -37.59 87.46 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.165 -179.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.4 ' NE2' ' O ' ' A' ' 61' ' ' VAL . 35.3 mt-30 -74.28 -40.52 62.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.68 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 3.3 mt -64.79 -24.25 67.49 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.682 179.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 17.8 t-20 -62.47 -27.73 69.33 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.42 179.592 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 8.0 mmtt -72.92 -18.42 61.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.205 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 18.7 mt -68.79 -52.71 27.35 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.893 0.378 . . . . 0.0 110.551 179.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -77.03 -12.51 59.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.042 179.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.411 ' O ' ' CB ' ' A' ' 90' ' ' LYS . 2.2 m80 66.61 -71.37 0.09 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.086 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.411 ' CB ' ' O ' ' A' ' 89' ' ' HIS . 0.0 OUTLIER 80.58 30.27 0.2 Allowed 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.835 179.991 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 166.52 78.5 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.522 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -117.58 170.52 8.69 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.832 0.348 . . . . 0.0 110.938 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -144.15 -65.07 0.36 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.114 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.03 -37.2 85.28 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.924 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 4.3 ttm180 -68.21 -45.81 72.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.909 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -61.29 160.2 11.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.11 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -154.58 36.4 0.41 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.141 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -131.83 -48.79 0.95 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.892 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 48.2 p -143.03 133.69 25.14 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.895 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 8.9 p -107.61 -26.28 3.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.233 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.73 98.12 6.87 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.927 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -143.98 -57.13 0.38 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.877 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -121.09 -68.93 0.87 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.027 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 45.2 m-20 62.53 -80.74 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.103 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 64.23 -79.06 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.974 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 15.4 m -138.32 -45.36 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.142 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 63.06 94.26 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.837 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 29.2 mm-40 -88.64 99.99 12.75 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.936 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 10.6 p -163.0 137.9 1.38 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.03 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -138.58 77.2 1.61 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.962 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -105.09 -31.33 9.22 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.841 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 13.6 tt0 . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.208 -0.901 . . . . 0.0 110.89 -179.995 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 3.7 t . . . . . 0 N--CA 1.486 1.346 0 CA-C-O 120.78 0.324 . . . . 0.0 111.212 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.29 137.29 36.58 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.841 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -120.78 98.8 6.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.15 -179.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 34.2 mt -102.63 124.16 56.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.643 179.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.8 p -134.25 159.58 40.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.987 0.422 . . . . 0.0 111.097 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 21.5 p -163.86 143.8 8.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.668 -179.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.6 mtmp? -102.51 35.89 2.32 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.035 -179.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -141.11 -47.63 0.4 Allowed 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.777 179.718 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 14.3 mtm -126.22 176.44 7.07 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.691 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -99.79 173.96 6.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.828 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 6.0 mm -91.77 110.76 23.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 121.097 0.475 . . . . 0.0 111.075 -179.677 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 13.2 p -97.52 149.5 35.78 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.146 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_exo -55.84 -20.59 29.51 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.423 2.082 . . . . 0.0 111.746 179.06 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -76.15 -43.92 40.67 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.046 0.45 . . . . 0.0 110.339 179.242 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 32.2 mt -72.34 -27.85 27.37 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.283 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.58 179.118 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 29.4 ttt-85 -77.45 -43.68 31.6 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.714 -0.676 . . . . 0.0 109.531 178.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 34.3 tt0 -67.64 -40.69 84.58 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.638 179.067 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.54 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 79.5 t60 -60.99 -57.32 13.13 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.711 -0.395 . . . . 0.0 109.964 179.167 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 26.9 t -60.35 -47.81 90.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 178.675 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.69 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -59.72 -40.12 86.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.208 -0.451 . . . . 0.0 112.087 179.793 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.54 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 0.9 OUTLIER -59.59 -35.33 74.09 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 120.497 -0.481 . . . . 0.0 109.999 179.918 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -76.42 -27.21 56.18 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.775 179.557 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.69 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 5.3 mt -66.48 -56.03 12.82 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.046 0.45 . . . . 0.0 110.225 179.509 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.26 -21.62 64.08 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.162 179.555 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 6.0 tmtm? -79.24 -29.3 42.63 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.686 179.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.446 ' HB3' ' HB2' ' A' ' 29' ' ' TRP . 0.4 OUTLIER -78.31 61.15 2.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.666 -179.991 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.36 -52.08 66.75 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.751 -0.658 . . . . 0.0 111.869 -179.448 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.437 ' HG2' ' NE1' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -86.46 28.05 0.89 Allowed 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 120.853 0.359 . . . . 0.0 111.466 -179.595 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.446 ' HB2' ' HB3' ' A' ' 26' ' ' LEU . 10.0 m95 -149.62 161.98 41.11 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.361 -179.527 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . 0.402 ' CG ' ' CD1' ' A' ' 33' ' ' LEU . 1.0 OUTLIER 61.19 27.2 16.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.454 -179.284 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 8.8 t -79.99 -23.11 41.8 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.521 -179.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 2.1 p80 -123.27 69.43 1.01 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.999 0.428 . . . . 0.0 111.01 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.402 ' CD1' ' CG ' ' A' ' 30' ' ' GLN . 23.4 mt -129.1 154.73 46.41 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.334 179.702 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.5 mp -139.49 100.06 1.3 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.809 0.338 . . . . 0.0 111.479 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 36.2 m-20 61.81 71.72 0.72 Allowed Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.372 179.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -75.17 151.73 39.12 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.532 2.154 . . . . 0.0 111.844 179.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -138.61 126.52 22.42 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.945 0.402 . . . . 0.0 111.521 -179.647 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.406 ' N ' ' CD1' ' A' ' 38' ' ' ILE . 3.4 mp -118.88 135.71 58.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.626 179.521 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 5.3 mt -116.73 147.08 20.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.227 -179.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.3 mt -121.9 127.23 50.21 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.696 179.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -124.1 -172.42 2.54 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.482 179.913 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.422 ' HG3' ' CD2' ' A' ' 47' ' ' PHE . 1.5 ttpt -161.52 139.52 9.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.299 0.571 . . . . 0.0 111.274 -179.686 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -130.81 157.54 77.55 Favored Pre-proline 0 C--N 1.323 -0.553 0 CA-C-N 115.189 -0.914 . . . . 0.0 109.306 179.159 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 70.9 Cg_exo -51.48 -24.63 17.1 Favored 'Trans proline' 0 N--CA 1.464 -0.215 0 C-N-CA 122.012 1.808 . . . . 0.0 112.464 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.5 tt0 -89.2 -6.08 57.18 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.479 -0.782 . . . . 0.0 112.659 -179.14 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 148.86 -160.91 28.56 Favored Glycine 0 C--O 1.224 -0.511 0 C-N-CA 120.289 -0.957 . . . . 0.0 112.224 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.456 ' N ' ' CD1' ' A' ' 47' ' ' PHE . 13.6 m-85 -110.17 154.74 22.91 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.574 0.702 . . . . 0.0 112.096 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 93.7 t -127.22 140.0 50.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 114.691 -1.141 . . . . 0.0 111.036 -179.012 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -131.49 122.19 25.76 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.41 179.402 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -120.3 149.32 42.49 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.691 0.281 . . . . 0.0 111.071 -179.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . 0.42 ' N ' HD13 ' A' ' 76' ' ' LEU . . . -146.55 140.04 25.84 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.815 0.341 . . . . 0.0 111.32 179.535 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.0 m -134.33 131.86 38.83 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.031 179.484 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 21.9 mt -132.25 136.22 56.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 121.043 0.449 . . . . 0.0 111.676 -179.427 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 8.3 m120 -100.97 120.74 40.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.596 179.142 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.453 ' HB ' ' HD2' ' A' ' 56' ' ' PRO . 5.5 p -113.46 173.4 2.89 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.244 179.862 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.453 ' HD2' ' HB ' ' A' ' 55' ' ' THR . 86.5 Cg_endo -86.98 1.67 7.29 Favored 'Trans proline' 0 N--CA 1.457 -0.642 0 C-N-CA 122.353 2.036 . . . . 0.0 112.632 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 5.0 m120 -131.58 20.95 4.68 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.315 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 139.99 -167.57 25.35 Favored Glycine 0 C--N 1.331 0.265 0 C-N-CA 120.603 -0.808 . . . . 0.0 112.646 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 19.0 t -128.68 144.12 39.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.757 0.313 . . . . 0.0 111.178 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 16.7 mt -118.33 144.4 45.89 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.026 -179.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 21.6 t -140.26 144.69 27.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.147 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -153.37 149.77 28.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.063 0.459 . . . . 0.0 111.419 -179.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 56.0 p -145.08 159.93 42.19 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.866 -179.239 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -150.96 107.33 0.34 Allowed Glycine 0 C--N 1.333 0.371 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.713 179.408 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -105.25 43.99 1.07 Allowed 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.062 0.393 . . . . 0.0 112.062 -178.813 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.412 ' CE1' HG23 ' A' ' 71' ' ' THR . 13.0 t-80 -77.45 155.51 31.71 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.713 0.292 . . . . 0.0 110.561 179.2 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -61.08 -26.91 67.98 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.337 179.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -98.68 118.99 36.65 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.983 0.42 . . . . 0.0 111.401 -179.313 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.8 tmt? -48.01 -45.77 32.21 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.547 179.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 34.4 m-85 -66.52 -41.05 89.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.222 -179.483 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.412 HG23 ' CE1' ' A' ' 66' ' ' HIS . 90.7 m -65.26 -38.28 89.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.877 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.25 -50.82 70.22 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.87 179.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 8.6 mt -62.01 -42.65 95.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.713 0.292 . . . . 0.0 110.275 179.511 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -63.91 -41.89 97.55 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.957 0.408 . . . . 0.0 110.1 179.206 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -65.93 -41.4 91.41 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.506 179.494 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.42 HD13 ' N ' ' A' ' 51' ' ' ALA . 0.3 OUTLIER -53.45 -62.92 1.34 Allowed 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 179.218 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 42.8 mt -54.74 -27.21 18.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 110.227 -0.286 . . . . 0.0 110.227 178.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -58.99 -39.98 83.46 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 178.0 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.1 -30.62 65.27 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 114.844 -1.071 . . . . 0.0 109.944 178.613 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 94.5 mt -63.66 -46.63 84.75 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 107.899 -1.148 . . . . 0.0 107.899 177.575 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 8.2 tt0 -59.98 -51.97 67.41 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 114.894 -1.048 . . . . 0.0 110.628 177.791 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.93 -25.43 68.14 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.384 -179.655 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -74.71 -47.6 30.52 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.837 0.351 . . . . 0.0 110.774 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.1 mt -64.59 -25.37 67.94 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.809 179.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 -63.47 -33.29 75.25 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.923 0.392 . . . . 0.0 110.386 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.49 -31.9 63.99 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.491 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.478 ' O ' ' CE1' ' A' ' 89' ' ' HIS . 6.5 tt -68.77 -27.89 66.29 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.964 -179.899 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . 0.462 ' O ' ' N ' ' A' ' 90' ' ' LYS . 21.0 mt-30 -80.91 -32.98 34.5 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.948 0.404 . . . . 0.0 111.24 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.478 ' CE1' ' O ' ' A' ' 87' ' ' LEU . 0.0 OUTLIER 42.88 -87.73 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.604 -179.447 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.462 ' N ' ' O ' ' A' ' 88' ' ' GLN . 1.8 mmmm 47.41 -174.78 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 120.929 0.395 . . . . 0.0 111.442 -179.946 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 162.94 -83.73 0.11 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.68 -0.771 . . . . 0.0 112.465 -179.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -117.99 -175.74 2.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.825 0.345 . . . . 0.0 110.894 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -153.96 157.51 39.27 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.119 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -83.84 136.97 33.92 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.89 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.82 36.48 22.03 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.931 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -92.5 123.95 36.19 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.026 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -138.62 -55.9 0.62 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.139 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 28.3 m -131.54 -58.62 0.98 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.823 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 4.2 m -128.62 119.78 25.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.777 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 13.8 m -150.02 31.07 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.104 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 20.0 tttt -92.32 140.09 29.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.88 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 13.1 p-10 -74.9 167.31 22.12 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.882 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -130.29 172.98 11.24 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.056 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -60.32 145.15 48.75 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.923 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 29.0 m-85 -82.89 146.63 28.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.979 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 21.4 t -98.15 -45.56 12.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.041 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -92.53 -18.12 23.56 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.262 179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 65.07 34.1 9.02 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.866 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 27.0 m -98.07 117.68 43.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.053 179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 61.52 167.96 0.1 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.831 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -97.71 -31.7 12.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.897 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 . . . . . 0 C--O 1.25 1.107 0 CA-C-O 118.253 -0.88 . . . . 0.0 110.916 -179.974 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.488 1.44 0 CA-C-O 120.781 0.324 . . . . 0.0 111.194 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.9 ttp -59.39 136.59 58.02 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.89 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 43.9 t-20 -127.85 98.87 5.31 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.3 -179.819 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 18.3 pt -105.09 130.0 56.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.459 179.331 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 3.1 p -132.9 169.93 16.06 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.879 0.371 . . . . 0.0 111.052 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.404 ' HB3' ' HB2' ' A' ' 40' ' ' LEU . 25.0 p -162.84 136.71 6.14 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.314 -179.441 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -101.15 37.26 1.8 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.952 -179.781 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -140.82 -48.98 0.43 Allowed 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.592 179.625 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -123.11 174.27 7.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.55 179.78 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.5 pm0 -93.95 165.17 12.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.518 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.5 mm -90.98 114.33 28.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 121.012 0.434 . . . . 0.0 110.983 -179.514 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 11.2 p -99.57 150.0 36.39 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.004 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -56.98 -19.24 31.47 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.318 2.012 . . . . 0.0 111.755 178.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -76.8 -42.77 39.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.092 0.473 . . . . 0.0 110.257 179.27 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 31.9 mt -72.62 -28.59 28.16 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 CA-C-N 115.575 -0.739 . . . . 0.0 109.446 178.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.41 ' O ' ' CB ' ' A' ' 20' ' ' ALA . 53.2 mtp180 -74.82 -45.84 40.7 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.609 178.696 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -67.35 -38.52 84.95 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.616 179.158 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.465 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 77.8 t60 -60.25 -61.74 2.38 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 179.075 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.422 ' O ' ' HG ' ' A' ' 23' ' ' LEU . 18.9 t -60.56 -47.18 93.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 116.618 -0.264 . . . . 0.0 110.676 178.933 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.669 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -58.14 -44.91 88.1 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.354 0.501 . . . . 0.0 112.354 -179.962 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.465 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 0.9 OUTLIER -59.83 -32.84 71.03 Favored 'General case' 0 C--N 1.333 -0.146 0 C-N-CA 120.364 -0.534 . . . . 0.0 110.219 -179.542 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.434 ' HD2' ' OD1' ' A' ' 21' ' ' ASP . 0.0 OUTLIER -73.1 -28.44 62.28 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.652 179.181 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.669 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 5.1 mt -68.44 -53.86 20.8 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.954 0.406 . . . . 0.0 110.599 179.536 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.34 -23.81 62.82 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.233 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -79.22 -33.36 43.77 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 121.206 0.527 . . . . 0.0 110.113 179.346 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.606 ' HB3' ' HB2' ' A' ' 29' ' ' TRP . 6.1 mt -80.23 57.12 2.65 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.047 -179.718 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.36 -72.03 0.14 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.3 -179.861 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.435 ' HE2' ' CH2' ' A' ' 29' ' ' TRP . 3.1 tttt -52.82 -24.12 8.34 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.239 0.542 . . . . 0.0 111.105 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.606 ' HB2' ' HB3' ' A' ' 26' ' ' LEU . 37.6 m95 -84.03 -78.14 0.24 Allowed 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.875 -179.682 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 60.9 mt-30 -81.24 55.67 2.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.835 0.35 . . . . 0.0 111.207 -179.589 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.9 t -80.39 -47.22 14.74 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.934 0.397 . . . . 0.0 110.584 179.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . 0.452 ' CD2' ' HG ' ' A' ' 33' ' ' LEU . 0.4 OUTLIER -91.59 -126.33 0.09 Allowed 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.664 179.818 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.452 ' HG ' ' CD2' ' A' ' 32' ' ' HIS . 0.6 OUTLIER 73.34 152.51 0.13 Allowed 'General case' 0 N--CA 1.464 0.227 0 O-C-N 122.213 -0.304 . . . . 0.0 110.688 -179.696 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 2.8 mm -137.54 99.04 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-O 120.739 0.304 . . . . 0.0 111.519 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 61.08 78.1 0.33 Allowed Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.639 179.35 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -80.54 154.43 20.94 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.652 2.235 . . . . 0.0 112.0 179.316 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -138.34 127.95 24.94 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.976 0.417 . . . . 0.0 111.411 -179.617 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 4.9 mp -120.32 137.2 54.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.929 179.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 28.1 mt -119.54 142.21 35.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.172 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.404 ' HB2' ' HB3' ' A' ' 6' ' ' SER . 10.0 mt -120.36 130.15 54.27 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.97 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 14.9 m -125.22 -170.65 2.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.528 179.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.419 ' HG3' ' CD2' ' A' ' 47' ' ' PHE . 3.5 ttpt -158.67 141.41 14.44 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.431 0.634 . . . . 0.0 111.359 -179.7 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -131.32 156.86 79.56 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 115.113 -0.949 . . . . 0.0 109.217 179.143 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_exo -51.82 -24.46 18.54 Favored 'Trans proline' 0 C--O 1.232 0.198 0 C-N-CA 121.942 1.761 . . . . 0.0 112.375 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 34.5 tt0 -89.44 -6.71 56.28 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.501 -0.772 . . . . 0.0 112.778 -179.146 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 149.22 -162.56 29.02 Favored Glycine 0 C--O 1.225 -0.422 0 C-N-CA 120.269 -0.967 . . . . 0.0 112.205 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.419 ' CD2' ' HG3' ' A' ' 42' ' ' LYS . 18.5 m-85 -109.06 152.65 24.74 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.548 0.689 . . . . 0.0 112.026 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 63.8 t -126.51 141.01 47.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 114.829 -1.078 . . . . 0.0 110.912 -179.324 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -132.13 123.78 27.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.753 179.645 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -119.52 149.84 41.24 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.603 0.24 . . . . 0.0 110.855 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -147.3 139.89 24.78 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.72 0.295 . . . . 0.0 111.419 179.615 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.0 m -135.78 129.88 33.19 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.924 -0.399 . . . . 0.0 109.924 179.226 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.443 ' CG2' ' HB3' ' A' ' 33' ' ' LEU . 8.3 mt -133.03 140.42 47.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-O 121.177 0.513 . . . . 0.0 111.96 -179.326 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 8.6 m120 -100.89 118.72 37.49 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.496 -0.774 . . . . 0.0 110.775 179.212 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 5.9 p -111.05 146.27 34.16 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.153 179.327 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -58.01 -17.52 31.51 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.27 1.98 . . . . 0.0 112.573 -179.451 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -118.67 23.68 11.33 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.581 -0.282 . . . . 0.0 111.572 -179.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 143.99 -165.2 27.38 Favored Glycine 0 C--N 1.331 0.263 0 C-N-CA 120.427 -0.892 . . . . 0.0 113.073 179.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 18.4 t -139.84 142.77 31.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.802 0.334 . . . . 0.0 111.015 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.9 mt -118.64 146.39 44.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.947 0.403 . . . . 0.0 111.299 -179.659 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 21.6 t -139.37 145.3 27.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.807 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -154.03 151.64 29.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.2 0.524 . . . . 0.0 111.648 -179.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' SER . . . . . 0.403 ' HA ' HD12 ' A' ' 76' ' ' LEU . 0.8 OUTLIER -143.13 156.71 44.85 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.416 -0.811 . . . . 0.0 111.575 -179.393 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -151.43 105.86 0.29 Allowed Glycine 0 C--N 1.331 0.305 0 N-CA-C 111.487 -0.645 . . . . 0.0 111.487 179.443 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -107.92 45.06 1.03 Allowed 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 -178.806 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 15.2 t-80 -75.74 156.15 34.89 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.732 0.301 . . . . 0.0 110.353 178.552 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -60.61 -27.48 67.78 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.323 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -97.89 120.73 38.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.031 0.443 . . . . 0.0 111.461 -179.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -48.15 -48.21 34.41 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.724 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 8.2 m-85 -66.4 -41.16 89.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.332 -179.338 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 60.1 m -64.99 -39.49 93.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.798 0.333 . . . . 0.0 110.699 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.72 -50.42 72.49 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.672 179.642 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.404 ' CG1' ' CD2' ' A' ' 40' ' ' LEU . 8.5 mt -60.87 -43.56 95.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.88 0.372 . . . . 0.0 110.324 179.515 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -63.93 -38.87 92.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.091 179.272 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -66.17 -44.77 83.08 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.409 179.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.403 HD12 ' HA ' ' A' ' 63' ' ' SER . 0.3 OUTLIER -51.4 -58.97 4.8 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 179.038 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 43.5 mt -57.36 -29.32 32.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 109.916 -0.402 . . . . 0.0 109.916 178.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -58.84 -30.54 67.75 Favored 'General case' 0 N--CA 1.442 -0.859 0 CA-C-O 121.192 0.52 . . . . 0.0 109.932 178.079 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.5 mptt -84.0 -27.93 28.07 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.387 -0.824 . . . . 0.0 109.834 178.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 89.8 mt -63.74 -49.55 72.6 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 177.493 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.421 ' HG3' ' CD1' ' A' ' 29' ' ' TRP . 9.0 tt0 -60.26 -50.18 74.67 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 114.862 -1.063 . . . . 0.0 110.501 177.616 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.88 -25.14 68.15 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.098 -179.741 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 8.4 mt-30 -75.33 -45.68 37.97 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.926 0.393 . . . . 0.0 110.42 179.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.1 mt -65.81 -30.98 71.69 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.83 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 47.1 t30 -61.82 -27.75 68.99 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.698 -179.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.412 ' HA ' ' CD2' ' A' ' 89' ' ' HIS . 2.9 mmtt -72.59 -23.66 60.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.142 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 19.9 mt -69.56 -15.5 63.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.265 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -76.62 -7.13 54.63 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.624 -0.262 . . . . 0.0 111.364 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.412 ' CD2' ' HA ' ' A' ' 86' ' ' LYS . 64.6 m-70 -85.16 -67.78 0.78 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.786 0.327 . . . . 0.0 110.865 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 42.11 -164.39 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.601 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 118.22 35.77 0.99 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.518 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -108.03 96.3 6.28 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.804 0.335 . . . . 0.0 110.912 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -78.24 -28.52 47.85 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.152 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 10.1 mmt-85 -59.24 113.73 2.29 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.941 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.04 158.78 15.35 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.942 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -81.93 96.89 7.82 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.149 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -69.27 91.19 0.52 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.085 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 63.58 138.81 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.87 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -178.42 94.72 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.871 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 10.6 m -138.28 79.9 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.125 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 3.2 pttt -112.3 -35.14 5.69 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.946 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 41.2 m-20 -89.62 139.1 30.88 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.906 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . 60.5 95.13 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.147 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 17.3 t-20 -115.07 75.11 0.91 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.885 179.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -165.66 -168.93 1.42 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.956 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 28.8 t -121.74 82.03 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.039 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -67.97 -64.51 0.85 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.839 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -148.97 -66.61 0.23 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.876 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 5.4 m -140.23 100.16 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.137 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -118.83 -41.72 2.77 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.904 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -145.78 166.17 26.69 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.935 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 . . . . . 0 C--O 1.25 1.102 0 CA-C-O 118.212 -0.899 . . . . 0.0 110.866 179.976 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 8.6 t . . . . . 0 N--CA 1.487 1.412 0 CA-C-O 120.738 0.304 . . . . 0.0 111.146 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -143.27 166.01 25.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.95 179.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -124.87 130.56 52.61 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.196 -179.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 38.7 mt -132.7 126.84 55.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.833 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -133.63 162.2 32.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.988 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 21.5 p -164.08 136.92 5.1 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.631 -179.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.94 39.26 1.49 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.797 -179.891 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -140.6 -47.81 0.42 Allowed 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.687 179.824 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -133.64 -178.36 4.97 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.898 179.792 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -93.23 164.03 13.39 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.671 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 3.7 mm -90.31 121.05 40.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.886 0.374 . . . . 0.0 110.695 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 17.7 p -101.81 148.21 34.97 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.086 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -56.77 -19.75 32.35 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.413 2.076 . . . . 0.0 111.773 179.203 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -77.61 -40.66 41.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.223 0.535 . . . . 0.0 110.374 179.618 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 26.4 mt -73.09 -31.27 34.4 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.327 178.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.433 ' O ' ' CB ' ' A' ' 20' ' ' ALA . 6.8 mtt85 -72.64 -46.45 53.99 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.512 178.616 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -67.09 -34.81 78.44 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.332 178.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.441 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 78.7 t60 -59.4 -66.02 0.58 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.039 0.447 . . . . 0.0 109.968 178.909 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 15.7 t -61.41 -46.04 97.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.887 179.166 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.631 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -55.56 -48.25 75.07 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 111.601 0.222 . . . . 0.0 111.601 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.441 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 2.7 p30 -59.51 -28.82 67.39 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.885 0.374 . . . . 0.0 110.538 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 18.2 mmt180 -74.75 -29.2 61.07 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.517 179.451 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.631 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 1.1 mt -69.44 -49.65 53.06 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.594 179.185 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.87 -24.96 62.85 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.915 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.45 -37.41 43.65 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.569 179.315 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.6 mt -82.27 55.92 3.04 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.81 179.625 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -118.15 20.96 13.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.564 -179.745 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.63 -6.24 33.69 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.754 0.312 . . . . 0.0 111.195 179.74 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.436 ' CD2' ' HB3' ' A' ' 84' ' ' LEU . 30.8 m95 -86.61 -175.77 5.56 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.033 -179.756 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 2.1 mm100 -128.32 74.3 1.54 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.296 0.57 . . . . 0.0 111.161 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.443 ' CG2' ' O ' ' A' ' 31' ' ' THR . 14.9 t -162.32 87.52 0.63 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.088 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 12.2 m-70 -48.2 101.25 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.636 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.489 HD13 ' CG2' ' A' ' 55' ' ' THR . 0.6 OUTLIER -64.98 128.0 33.93 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.044 -0.525 . . . . 0.0 109.76 -179.868 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 6.1 mt -127.5 116.61 44.24 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.259 0 CA-C-O 121.811 0.815 . . . . 0.0 112.143 -178.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.443 ' N ' ' CD ' ' A' ' 36' ' ' PRO . 28.5 m-80 73.45 48.0 0.22 Allowed Pre-proline 0 C--N 1.322 -0.615 0 CA-C-N 114.227 -1.352 . . . . 0.0 111.922 178.834 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.443 ' CD ' ' N ' ' A' ' 35' ' ' ASN . 16.0 Cg_endo -57.93 129.17 31.96 Favored 'Trans proline' 0 C--N 1.343 0.289 0 C-N-CA 122.207 1.938 . . . . 0.0 111.745 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 2.0 t-160 -134.01 132.63 40.33 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.03 0.443 . . . . 0.0 111.521 -179.711 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 24.5 mm -123.19 133.7 68.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.773 179.726 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 37.0 mt -120.63 142.21 37.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.875 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 6.1 mt -121.48 127.41 51.04 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.988 0.423 . . . . 0.0 110.813 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -124.47 -171.35 2.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.602 179.813 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.466 ' HA ' ' HA ' ' A' ' 47' ' ' PHE . 0.0 OUTLIER -172.73 146.33 1.62 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.191 0.52 . . . . 0.0 111.018 -179.758 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.419 ' HB3' ' HD2' ' A' ' 44' ' ' PRO . 30.2 mm-40 -131.9 166.89 25.0 Favored Pre-proline 0 C--N 1.324 -0.527 0 CA-C-N 115.415 -0.811 . . . . 0.0 109.11 179.137 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . 0.419 ' HD2' ' HB3' ' A' ' 43' ' ' GLU . 71.4 Cg_exo -49.35 -20.35 3.69 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 121.764 1.643 . . . . 0.0 112.443 -179.327 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 28.9 tt0 -85.44 -76.89 0.31 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.122 179.156 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . 0.412 ' HA3' ' HA ' ' A' ' 67' ' ' GLU . . . -142.44 -156.79 6.91 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.688 -0.767 . . . . 0.0 112.645 -179.339 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.466 ' HA ' ' HA ' ' A' ' 42' ' ' LYS . 21.4 m-85 -108.17 151.05 26.44 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.607 0.718 . . . . 0.0 112.58 -179.315 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.421 ' HA ' ' HA ' ' A' ' 65' ' ' LYS . 63.5 t -124.61 142.61 40.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 114.543 -1.208 . . . . 0.0 110.537 -179.775 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.428 ' O ' ' HA ' ' A' ' 63' ' ' SER . . . -133.09 125.17 29.0 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.026 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -118.39 145.69 44.98 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.356 179.765 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . 0.445 ' N ' HD12 ' A' ' 76' ' ' LEU . . . -144.69 142.2 29.89 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.798 -0.361 . . . . 0.0 111.602 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 9.2 m -136.14 135.6 39.38 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.582 179.735 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 4.0 mm -132.51 133.63 59.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.709 0.29 . . . . 0.0 110.915 -179.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -108.98 121.81 45.92 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.529 179.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.489 ' CG2' HD13 ' A' ' 33' ' ' LEU . 28.4 p -121.67 164.99 21.49 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.1 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 20.0 Cg_exo -65.9 -11.73 32.18 Favored 'Trans proline' 0 C--N 1.343 0.288 0 C-N-CA 122.785 2.323 . . . . 0.0 112.763 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -111.06 -3.39 15.51 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 111.819 0.303 . . . . 0.0 111.819 -179.601 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 152.39 -167.2 31.34 Favored Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.467 -0.873 . . . . 0.0 112.765 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 17.2 t -131.95 140.65 47.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.73 0.3 . . . . 0.0 111.144 -179.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.7 mt -117.54 153.81 32.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.889 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 13.8 p -140.42 149.62 21.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.307 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -153.99 154.73 34.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.098 0.475 . . . . 0.0 111.411 -179.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' SER . . . . . 0.428 ' HA ' ' O ' ' A' ' 49' ' ' ALA . 0.1 OUTLIER -144.79 157.31 44.22 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.753 -179.315 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -151.87 105.16 0.28 Allowed Glycine 0 C--N 1.331 0.304 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.61 179.4 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.421 ' HA ' ' HA ' ' A' ' 48' ' ' VAL . 8.7 mtpt -107.62 44.73 1.06 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -178.65 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.421 ' CG ' HG23 ' A' ' 71' ' ' THR . 13.9 t-80 -76.18 156.29 33.8 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.877 0.37 . . . . 0.0 110.421 178.522 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.412 ' HA ' ' HA3' ' A' ' 46' ' ' GLY . 1.2 tt0 -60.88 -26.9 67.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.786 0.327 . . . . 0.0 111.119 179.844 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -97.59 123.93 41.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.028 0.442 . . . . 0.0 111.458 -179.292 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 17.1 ttt -48.2 -50.27 29.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.834 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -66.24 -36.74 83.79 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.635 -179.118 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.421 HG23 ' CG ' ' A' ' 66' ' ' HIS . 98.7 m -64.34 -42.28 96.35 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.721 0.296 . . . . 0.0 110.529 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.2 -47.52 85.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.37 179.442 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 14.7 mt -60.35 -47.11 93.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.548 179.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -63.96 -39.14 93.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.596 179.65 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -65.49 -44.97 85.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.469 179.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.445 HD12 ' N ' ' A' ' 51' ' ' ALA . 0.2 OUTLIER -53.01 -57.84 9.0 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 179.194 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 9.3 mt -57.01 -31.97 38.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 178.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -59.11 -30.06 67.83 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-O 121.139 0.495 . . . . 0.0 110.324 178.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 3.8 mptt -84.65 -25.71 28.31 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.217 179.092 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 90.5 mt -62.21 -48.87 78.08 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 107.599 -1.26 . . . . 0.0 107.599 177.111 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -60.22 -44.63 95.03 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 114.362 -1.29 . . . . 0.0 110.549 177.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 85.3 mtt180 -61.59 -31.38 71.43 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.882 -179.703 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 17.0 mt-30 -75.61 -39.78 57.39 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.936 0.398 . . . . 0.0 110.438 179.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.436 ' HB3' ' CD2' ' A' ' 29' ' ' TRP . 6.5 mt -66.09 -30.33 70.82 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.826 179.611 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -63.69 -22.64 67.01 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.908 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.467 ' O ' ' CG ' ' A' ' 89' ' ' HIS . 5.6 mmtm -71.59 -35.01 70.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.62 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.7 mt -72.36 -22.6 61.13 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.259 179.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -77.85 1.74 19.43 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.493 0.553 . . . . 0.0 112.493 -179.113 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.467 ' CG ' ' O ' ' A' ' 86' ' ' LYS . 0.7 OUTLIER -79.55 168.49 19.34 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.135 0.493 . . . . 0.0 111.512 -179.414 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -171.1 74.82 0.06 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.898 179.532 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 162.99 94.24 0.1 OUTLIER Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.488 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -73.37 80.97 1.39 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.85 0.357 . . . . 0.0 110.954 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . 59.42 94.65 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.203 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.88 165.7 0.06 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.894 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 10.6 mtm180 -141.35 -48.89 0.4 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.934 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -139.84 126.71 20.74 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.102 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . 60.45 -176.15 0.11 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.134 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 1.2 p -82.33 -63.23 1.42 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.855 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 67.5 m -128.23 148.46 50.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.853 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 29.5 t -80.18 82.54 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.112 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 30.3 mmtm -94.19 -34.61 12.85 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.89 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 71.3 m-20 -75.76 149.31 38.01 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.893 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -115.79 154.36 29.77 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.057 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 68.99 -67.47 0.21 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.912 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -139.1 114.35 9.6 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.791 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 27.4 m -69.11 -35.75 70.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.176 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -156.69 167.71 29.62 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.843 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -103.55 -74.6 0.63 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.868 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 11.1 p -67.18 142.43 16.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.091 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -120.28 137.98 53.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.913 179.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -102.43 -48.39 4.18 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.962 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.203 -0.903 . . . . 0.0 110.84 -179.997 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 2.2 m . . . . . 0 N--CA 1.487 1.416 0 CA-C-O 120.844 0.354 . . . . 0.0 111.173 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.5 tpt 60.18 87.77 0.08 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.852 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -124.24 116.49 22.76 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.484 -179.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.413 HD13 HG21 ' A' ' 4' ' ' ILE . 35.2 mt -118.98 125.23 74.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.396 179.389 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -134.35 162.63 31.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.907 0.384 . . . . 0.0 111.313 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.408 ' HB3' ' HB2' ' A' ' 40' ' ' LEU . 21.5 p -162.32 143.25 10.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.35 -179.744 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -102.81 -11.79 18.05 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.626 -179.452 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.03 -25.07 14.43 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 120.757 0.313 . . . . 0.0 111.132 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 1.4 mpp? -137.69 -165.98 1.87 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.871 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 13.6 tt0 -124.02 164.54 19.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.64 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.9 mm -91.2 111.32 23.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 121.075 0.464 . . . . 0.0 111.223 -179.497 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 15.1 p -98.22 152.72 38.13 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.034 179.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -58.5 -18.82 41.23 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.416 2.077 . . . . 0.0 111.757 179.278 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -79.19 -43.19 24.39 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.976 0.417 . . . . 0.0 110.519 179.27 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 30.4 mt -72.26 -28.8 29.95 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.412 178.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 19.5 mtm180 -74.63 -44.98 47.83 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.569 178.797 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 19.0 tt0 -67.69 -39.25 84.44 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.761 179.094 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.551 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 78.2 t60 -60.14 -58.18 9.64 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.623 -0.431 . . . . 0.0 109.881 179.018 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 44.3 t -60.86 -47.54 92.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-O 120.714 0.293 . . . . 0.0 110.258 178.453 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.672 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -58.25 -42.74 87.07 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.204 0.446 . . . . 0.0 112.204 179.77 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.551 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 0.9 OUTLIER -59.2 -35.83 74.3 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 121.007 0.432 . . . . 0.0 110.243 -179.898 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 5.2 mmm180 -76.09 -25.98 56.0 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.581 179.458 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.672 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 3.3 mt -68.31 -56.93 6.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.136 0.493 . . . . 0.0 110.393 179.542 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.08 -25.04 66.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.675 -179.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 7.8 tmtm? -79.11 -41.03 29.58 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.057 0.456 . . . . 0.0 110.506 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.691 ' HB3' ' HB2' ' A' ' 29' ' ' TRP . 7.0 mt -81.04 55.02 2.36 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.688 179.788 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -50.93 -63.97 0.96 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.375 -179.654 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.437 ' HG2' ' CD1' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -51.57 -34.22 36.0 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.296 0.569 . . . . 0.0 111.152 -179.891 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.691 ' HB2' ' HB3' ' A' ' 26' ' ' LEU . 9.2 m95 -90.01 48.71 1.61 Allowed 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.293 -0.867 . . . . 0.0 111.31 -179.581 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 170.92 97.91 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.347 179.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.43 ' CG2' ' N ' ' A' ' 32' ' ' HIS . 2.0 t -159.56 -47.78 0.05 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.018 -179.709 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . 0.43 ' N ' ' CG2' ' A' ' 31' ' ' THR . 18.0 m170 -82.35 -18.27 42.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.901 179.761 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.425 ' HB3' ' CG2' ' A' ' 53' ' ' ILE . 53.6 mt -57.44 153.85 11.96 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.863 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 29.0 mt -140.48 104.15 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.425 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 6.6 m120 57.71 76.77 0.45 Allowed Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.281 179.579 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -79.32 152.52 23.73 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.607 2.205 . . . . 0.0 112.022 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 2.0 t-160 -136.64 127.21 26.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.121 -179.7 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 3.3 mp -119.58 135.24 60.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.92 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 5.5 mt -116.54 142.94 27.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.808 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.408 ' HB2' ' HB3' ' A' ' 6' ' ' SER . 3.7 mm? -116.29 127.47 54.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.068 -179.867 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -123.5 -174.71 3.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.303 179.586 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.426 ' HG3' ' CD2' ' A' ' 47' ' ' PHE . 2.2 ttpp -159.99 139.35 11.05 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.282 0.563 . . . . 0.0 111.303 -179.731 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -130.9 156.07 80.56 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-N 115.091 -0.958 . . . . 0.0 109.241 179.161 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_exo -51.34 -24.39 15.77 Favored 'Trans proline' 0 N--CA 1.465 -0.186 0 C-N-CA 121.936 1.757 . . . . 0.0 112.464 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.31 -6.56 56.61 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.439 -0.8 . . . . 0.0 112.654 -179.177 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 149.82 -162.42 29.13 Favored Glycine 0 C--O 1.224 -0.483 0 C-N-CA 120.248 -0.977 . . . . 0.0 112.222 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.426 ' CD2' ' HG3' ' A' ' 42' ' ' LYS . 17.9 m-85 -110.01 154.55 23.02 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.425 0.631 . . . . 0.0 111.986 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 55.4 t -129.19 139.04 52.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 114.966 -1.015 . . . . 0.0 111.064 -179.297 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -129.82 123.34 30.67 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.265 179.47 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -119.08 149.67 41.29 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.718 0.294 . . . . 0.0 111.051 -179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . 0.43 ' N ' HD12 ' A' ' 76' ' ' LEU . . . -145.85 140.16 26.86 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.437 179.746 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.1 m -134.86 130.72 36.43 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.018 179.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.425 ' CG2' ' HB3' ' A' ' 33' ' ' LEU . 6.7 mt -132.69 137.3 54.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 121.047 0.451 . . . . 0.0 111.68 -179.478 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -102.28 134.96 44.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.796 179.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 6.0 p -129.88 160.55 64.46 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.418 179.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_exo -67.59 -10.51 28.97 Favored 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.461 2.108 . . . . 0.0 112.687 -179.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -115.79 -3.94 12.18 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 111.801 0.297 . . . . 0.0 111.801 -179.697 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 159.25 -167.12 34.91 Favored Glycine 0 C--N 1.331 0.282 0 C-N-CA 120.391 -0.909 . . . . 0.0 112.82 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 15.4 t -131.64 140.89 47.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 120.802 0.334 . . . . 0.0 111.163 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.5 mp -116.47 151.6 35.75 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.045 -179.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 14.1 p -139.96 149.05 22.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.147 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -154.93 150.2 27.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.302 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' SER . . . . . 0.442 ' HA ' HD11 ' A' ' 76' ' ' LEU . 0.9 OUTLIER -145.8 156.49 43.62 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.783 -179.402 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -150.04 104.6 0.28 Allowed Glycine 0 CA--C 1.519 0.335 0 N-CA-C 111.37 -0.692 . . . . 0.0 111.37 179.287 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 6.0 mtmt -106.93 45.11 1.0 Allowed 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -178.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 12.3 t-80 -75.72 156.91 34.23 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 178.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.4 pm0 -60.17 -27.24 66.95 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.759 0.314 . . . . 0.0 111.263 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -98.63 118.43 35.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.975 0.417 . . . . 0.0 111.301 -179.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 11.5 ttt -47.43 -45.04 25.3 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.559 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 8.5 m-85 -66.7 -39.67 88.17 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.072 -179.716 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 93.2 m -65.41 -38.79 91.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.73 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.62 -50.8 71.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.758 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 6.8 mt -62.08 -41.18 90.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-O 120.741 0.305 . . . . 0.0 110.243 179.355 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -64.06 -41.72 97.26 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.923 0.392 . . . . 0.0 110.047 179.096 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 62.0 mt-10 -67.26 -41.08 86.17 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.829 179.502 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.442 HD11 ' HA ' ' A' ' 63' ' ' SER . 0.4 OUTLIER -54.64 -64.78 0.72 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.326 179.662 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 55.5 mt -55.85 -26.79 21.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.567 -0.288 . . . . 0.0 110.272 178.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -58.53 -39.62 80.66 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 178.066 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.16 -30.86 63.88 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.834 -1.076 . . . . 0.0 110.287 178.754 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.4 ' O ' ' HB2' ' A' ' 83' ' ' GLN . 90.3 mt -61.66 -45.2 95.06 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 107.61 -1.256 . . . . 0.0 107.61 177.451 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.422 ' O ' ' CZ3' ' A' ' 29' ' ' TRP . 21.9 tt0 -57.33 -52.57 64.83 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 114.807 -1.088 . . . . 0.0 110.287 177.332 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 39.7 mtt180 -65.18 -16.55 63.64 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.566 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.4 ' HB2' ' O ' ' A' ' 80' ' ' LEU . 8.2 mt-30 -75.44 -55.3 5.83 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.564 0.221 . . . . 0.0 111.067 -179.826 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.493 ' HB2' ' HE3' ' A' ' 29' ' ' TRP . 2.5 mp -64.12 -27.68 69.25 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.089 0.471 . . . . 0.0 110.456 179.62 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . 0.47 ' N ' ' HZ3' ' A' ' 29' ' ' TRP . 11.8 t-20 -61.92 -36.27 80.87 Favored 'General case' 0 CA--C 1.521 -0.157 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.352 -179.27 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.435 ' O ' ' CG ' ' A' ' 89' ' ' HIS . 8.4 mmtm -73.0 -33.0 65.51 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.11 -179.757 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.7 mt -70.0 -12.19 61.43 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.558 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 7.2 mt-30 -77.63 -8.76 58.36 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 111.979 0.362 . . . . 0.0 111.979 -179.493 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.441 ' CD2' ' CG ' ' A' ' 90' ' ' LYS . 1.1 p-80 -85.93 175.6 8.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.961 0.41 . . . . 0.0 111.326 -179.831 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.441 ' CG ' ' CD2' ' A' ' 89' ' ' HIS . 6.1 mmmt 76.59 -67.9 0.2 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.083 179.64 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 98.39 87.21 1.88 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.283 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 63.16 117.98 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.833 0.349 . . . . 0.0 110.76 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.17 -70.88 0.25 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.117 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 11.0 ptt-85 -146.46 121.92 10.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.863 180.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.45 -32.32 6.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.924 -179.966 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -130.86 147.86 52.56 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.149 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -173.99 107.22 0.13 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.095 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 60.12 -176.31 0.1 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.931 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 3.1 p -157.17 -46.0 0.07 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.865 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 9.0 p -104.32 -25.63 3.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.142 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 3.6 mtpm? 61.46 175.92 0.12 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.914 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -133.91 32.12 3.54 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.968 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.69 -31.39 72.59 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.077 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -153.25 -46.97 0.09 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.889 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -176.42 -54.8 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.908 180.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 6.1 m -157.42 89.93 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.107 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 60.8 50.65 5.25 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.857 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 44.0 mm-40 60.72 112.47 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.952 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 8.0 m -115.76 135.43 55.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.085 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -130.63 122.69 27.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.881 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -111.76 -34.55 6.0 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.921 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.243 -0.884 . . . . 0.0 110.9 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 9.2 t . . . . . 0 N--CA 1.487 1.376 0 CA-C-O 120.841 0.353 . . . . 0.0 111.173 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' MET . . . . . 0.425 ' CG ' ' CD1' ' A' ' 23' ' ' LEU . 0.0 OUTLIER -126.95 175.63 7.92 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.944 179.887 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 39.4 t-20 -113.56 142.17 46.29 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.485 -179.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.404 HD11 HG23 ' A' ' 4' ' ' ILE . 21.2 mt -131.37 123.84 53.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.597 179.499 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.8 p -134.92 157.5 46.7 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.947 0.403 . . . . 0.0 111.31 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 21.7 p -163.32 143.32 8.82 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.508 -179.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.4 mtmt -101.05 12.56 37.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.294 -179.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -142.43 25.87 1.83 Allowed 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.801 179.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 2.4 mtm 179.37 172.51 0.89 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.859 -179.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 14.0 pm0 -114.9 168.41 9.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.477 179.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 6.5 mm -89.94 107.99 18.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 121.061 0.457 . . . . 0.0 111.349 -179.263 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 14.1 p -97.28 150.98 37.4 Favored Pre-proline 0 C--N 1.327 -0.389 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.831 179.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_endo -56.08 -26.8 61.57 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.475 2.117 . . . . 0.0 111.66 179.069 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -71.43 -44.6 64.54 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.634 179.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 34.7 mt -72.19 -27.92 27.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 178.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 63.1 mtm180 -76.39 -44.63 35.3 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.776 178.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -67.75 -40.37 84.1 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.686 179.14 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.524 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 78.1 t60 -60.57 -58.0 10.35 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 179.07 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.402 ' O ' ' HG ' ' A' ' 23' ' ' LEU . 22.0 t -60.01 -47.49 91.59 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.447 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 178.554 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.706 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -59.4 -39.66 84.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.934 179.654 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.524 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 0.9 OUTLIER -59.64 -34.75 73.2 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 121.134 0.492 . . . . 0.0 109.924 179.915 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 36.5 mmt180 -75.55 -25.4 57.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.713 179.35 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.706 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 14.8 mt -66.98 -55.82 12.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.104 0.478 . . . . 0.0 110.083 179.199 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.57 -21.92 63.12 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.135 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -78.91 -30.58 44.92 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.119 0.485 . . . . 0.0 110.312 179.375 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.516 ' HB3' ' HB2' ' A' ' 29' ' ' TRP . 0.5 OUTLIER -80.29 58.24 3.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.561 179.691 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.45 -79.48 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.647 -179.432 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.441 ' HG3' ' N ' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -49.66 -27.97 5.34 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-O 121.33 0.586 . . . . 0.0 111.164 -179.683 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.516 ' HB2' ' HB3' ' A' ' 26' ' ' LEU . 10.8 m95 -88.52 52.87 2.55 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.247 -0.888 . . . . 0.0 111.008 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -145.83 50.28 1.19 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.478 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -77.75 -165.63 0.66 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.955 -179.754 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 47.8 m-70 -50.38 108.18 0.21 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.048 0.451 . . . . 0.0 111.812 -179.34 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -134.95 145.75 48.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.613 179.24 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.1 mp -137.06 111.33 9.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 121.584 0.707 . . . . 0.0 112.371 -179.382 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 52.53 77.12 0.47 Allowed Pre-proline 0 C--N 1.327 -0.384 0 CA-C-N 114.654 -1.157 . . . . 0.0 112.646 178.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -80.02 145.71 17.72 Favored 'Trans proline' 0 N--CA 1.461 -0.401 0 C-N-CA 122.541 2.161 . . . . 0.0 110.966 178.335 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 1.4 t-160 -134.49 128.91 34.34 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.104 0.478 . . . . 0.0 112.155 -178.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 4.9 mp -119.49 133.52 66.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.152 179.189 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 38.4 mt -116.43 154.39 18.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.908 0.385 . . . . 0.0 111.51 -179.51 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -127.28 126.01 41.89 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.711 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 3.2 m -123.18 -176.67 3.48 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.655 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.481 ' HG3' ' CE2' ' A' ' 47' ' ' PHE . 0.1 OUTLIER -158.42 138.1 11.97 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.324 0.583 . . . . 0.0 111.26 -179.63 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -130.74 155.49 81.25 Favored Pre-proline 0 C--N 1.322 -0.614 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.393 179.285 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -51.16 -24.69 15.41 Favored 'Trans proline' 0 C--O 1.232 0.221 0 C-N-CA 122.013 1.809 . . . . 0.0 112.372 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.41 -6.5 56.51 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.582 -0.736 . . . . 0.0 112.612 -179.15 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 150.12 -162.58 29.25 Favored Glycine 0 C--O 1.224 -0.477 0 C-N-CA 120.245 -0.978 . . . . 0.0 112.3 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.481 ' CE2' ' HG3' ' A' ' 42' ' ' LYS . 11.3 m-85 -109.92 155.25 21.98 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.435 0.636 . . . . 0.0 111.927 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 49.1 t -129.2 139.09 52.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 114.945 -1.025 . . . . 0.0 111.205 -179.198 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -130.49 122.94 28.58 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.444 179.44 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -119.64 149.77 41.43 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.828 0.347 . . . . 0.0 111.017 -179.672 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . 0.41 ' N ' HD12 ' A' ' 76' ' ' LEU . . . -145.28 139.39 27.06 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.166 179.567 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.0 m -135.43 130.94 35.58 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.251 179.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 16.1 mt -132.72 135.27 57.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 120.912 0.387 . . . . 0.0 111.412 -179.653 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -103.13 134.49 46.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.442 179.365 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.415 ' HB ' ' HD2' ' A' ' 56' ' ' PRO . 58.1 p -133.07 157.44 78.31 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.561 179.809 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.415 ' HD2' ' HB ' ' A' ' 55' ' ' THR . 43.1 Cg_endo -68.31 -7.34 19.82 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.302 2.001 . . . . 0.0 112.716 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 88.5 m-20 -124.14 22.93 8.58 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.591 0.234 . . . . 0.0 111.604 -179.803 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 138.69 -165.51 25.55 Favored Glycine 0 C--N 1.331 0.294 0 C-N-CA 120.406 -0.902 . . . . 0.0 112.964 179.728 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 21.4 t -142.4 144.53 24.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.766 0.317 . . . . 0.0 111.122 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 8.4 mp -118.7 142.82 47.31 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.306 -179.667 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 21.4 t -140.81 142.33 30.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.907 179.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -153.51 154.39 34.24 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.257 0.551 . . . . 0.0 111.609 -179.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 80.3 p -145.09 159.55 42.79 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.828 -179.263 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -152.61 102.8 0.23 Allowed Glycine 0 C--N 1.331 0.305 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.47 179.466 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.42 44.33 1.05 Allowed 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -178.771 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 12.5 t-80 -75.23 156.28 35.92 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.589 -0.278 . . . . 0.0 110.253 178.57 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -60.2 -27.25 67.01 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.727 0.299 . . . . 0.0 111.364 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 32.5 t0 -97.66 116.53 30.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.931 0.396 . . . . 0.0 111.191 -179.375 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.4 ttt -46.92 -44.06 19.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.414 179.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -66.81 -42.38 85.98 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.886 -179.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 71.5 m -65.75 -37.51 86.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.917 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.96 -52.93 62.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.958 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 6.3 mt -61.6 -41.32 89.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.827 0.346 . . . . 0.0 110.235 179.505 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -63.7 -40.0 95.72 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.267 -0.424 . . . . 0.0 109.929 179.068 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -66.35 -41.6 89.3 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.478 179.293 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.41 HD12 ' N ' ' A' ' 51' ' ' ALA . 0.2 OUTLIER -52.74 -62.32 1.72 Allowed 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 179.042 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 4.9 mt -55.9 -29.14 25.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 178.507 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -59.26 -30.51 68.34 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-O 121.112 0.482 . . . . 0.0 110.14 178.27 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.408 ' CE ' ' HA ' ' A' ' 79' ' ' LYS . 0.1 OUTLIER -86.9 -28.02 23.05 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.446 179.069 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 92.5 mt -63.73 -48.82 75.51 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.048 -1.094 . . . . 0.0 108.048 177.596 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -60.21 -49.87 75.9 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 114.984 -1.007 . . . . 0.0 110.462 177.741 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 3.6 mtt180 -63.92 -25.51 68.18 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.476 -179.535 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 23.7 mt-30 -73.87 -45.93 47.95 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.811 0.339 . . . . 0.0 110.703 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.447 ' HB2' ' CE3' ' A' ' 29' ' ' TRP . 0.9 OUTLIER -64.84 -28.61 69.67 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.799 179.835 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -62.38 -28.64 69.92 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.003 0.43 . . . . 0.0 110.308 179.619 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.437 ' HG3' ' N ' ' A' ' 87' ' ' LEU . 0.0 OUTLIER -72.23 -30.4 64.86 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.394 179.628 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.437 ' N ' ' HG3' ' A' ' 86' ' ' LYS . 0.2 OUTLIER -66.42 -15.72 63.54 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.166 -179.745 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -76.51 -6.78 53.29 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.403 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.442 ' N ' ' CD2' ' A' ' 89' ' ' HIS . 3.3 m170 -86.29 -38.32 17.64 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.023 0.439 . . . . 0.0 110.713 179.749 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 13.3 mttt -69.12 154.88 41.32 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.98 -179.297 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -68.72 -24.36 75.45 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.62 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -56.39 103.72 0.12 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.847 0.356 . . . . 0.0 111.067 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -157.72 144.94 18.29 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.064 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 60.78 93.42 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.88 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 10.1 ttt-85 -154.12 96.07 1.91 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.923 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -152.82 163.24 40.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.055 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -152.24 121.64 6.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.108 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 75.7 p -72.26 139.87 48.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.892 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.9 m -138.02 148.6 45.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.928 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 21.4 t -137.12 -49.86 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.193 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 6.8 mttm -64.71 164.33 12.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.874 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 22.7 m-20 -78.89 166.16 22.71 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.915 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -134.55 32.81 3.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.039 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 3.8 t30 67.57 -70.35 0.12 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.037 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 47.1 p90 -122.71 -177.63 3.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.858 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 31.0 m -133.39 143.64 38.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.03 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 61.07 109.8 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.921 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -68.03 165.52 17.79 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.895 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 5.3 m -147.7 104.27 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.165 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -161.0 114.38 1.99 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.901 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -123.15 178.85 4.91 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.88 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.926 179.986 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.487 1.422 0 CA-C-O 120.833 0.349 . . . . 0.0 111.218 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 59.93 109.45 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.854 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -125.31 134.61 52.18 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.236 -179.708 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 9.0 tt -135.09 125.94 45.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.349 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 3.0 p -134.76 165.33 25.53 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.901 0.381 . . . . 0.0 111.446 -179.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 3.2 p -161.59 130.42 4.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.978 -0.556 . . . . 0.0 109.991 -179.388 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 15.0 mtmt -99.0 13.67 31.92 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.271 -179.601 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 11.2 tp60 -141.91 21.67 2.12 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.636 179.319 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 176.74 161.96 0.41 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.51 -179.754 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -96.62 160.28 14.47 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.21 179.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.404 HD12 HG22 ' A' ' 11' ' ' ILE . 3.9 mm -90.27 119.3 37.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.002 0.429 . . . . 0.0 111.202 -179.372 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 16.8 p -100.58 157.27 34.05 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.641 179.434 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_exo -61.01 -15.08 36.74 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.477 2.118 . . . . 0.0 112.233 179.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -88.7 -38.72 14.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.904 0.383 . . . . 0.0 110.725 179.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 18.2 mt -73.57 -31.75 33.62 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 N-CA-C 109.484 -0.562 . . . . 0.0 109.484 179.028 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.412 ' O ' ' CB ' ' A' ' 20' ' ' ALA . 0.4 OUTLIER -72.55 -46.62 53.62 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.273 178.749 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -67.04 -33.64 75.97 Favored 'General case' 0 N--CA 1.456 -0.171 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.189 178.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.426 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 77.6 t60 -58.85 -66.22 0.54 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.995 0.426 . . . . 0.0 109.854 178.659 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 12.2 t -61.39 -44.61 98.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.796 178.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.586 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -55.15 -50.13 70.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.56 179.703 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.426 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 3.1 p30 -59.02 -28.57 66.54 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-O 120.894 0.378 . . . . 0.0 110.567 -179.938 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 13.8 mmt180 -74.09 -28.84 61.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.447 179.349 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.586 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 1.1 mt -69.7 -47.35 63.5 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.304 179.086 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.99 -27.35 66.79 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.962 179.617 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -79.34 -31.91 43.17 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.775 179.539 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 10.1 mt -81.07 58.27 3.42 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.863 179.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -121.69 2.5 10.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.637 -179.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.9 -11.57 61.04 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.755 0.312 . . . . 0.0 111.423 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.435 ' CD2' ' HB3' ' A' ' 84' ' ' LEU . 55.0 m95 -85.9 158.18 19.99 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.118 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.8 mm100 -102.35 66.49 0.99 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.153 0.501 . . . . 0.0 110.819 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.402 ' O ' ' CG2' ' A' ' 31' ' ' THR . 11.4 t -160.43 106.73 1.52 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.104 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 18.9 m-70 -62.05 93.34 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.122 -0.945 . . . . 0.0 111.59 -179.171 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.4 mp -48.87 153.46 0.85 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.219 178.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 6.8 mt -149.75 127.21 2.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 121.744 0.783 . . . . 0.0 112.121 -179.429 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.403 ' N ' ' CD ' ' A' ' 36' ' ' PRO . 9.5 m120 65.26 50.85 0.85 Allowed Pre-proline 0 C--N 1.324 -0.517 0 CA-C-N 114.29 -1.323 . . . . 0.0 111.792 179.099 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.403 ' CD ' ' N ' ' A' ' 35' ' ' ASN . 21.7 Cg_endo -62.37 128.98 25.24 Favored 'Trans proline' 0 C--N 1.343 0.249 0 C-N-CA 121.997 1.798 . . . . 0.0 111.854 -179.46 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 19.5 t-160 -134.42 133.73 40.84 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.711 -0.396 . . . . 0.0 111.411 -179.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.431 ' N ' ' CD1' ' A' ' 38' ' ' ILE . 2.7 mp -126.17 131.09 71.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.666 179.619 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 25.1 mt -121.31 138.93 50.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.71 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 10.0 mt -121.31 127.96 51.84 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.949 0.404 . . . . 0.0 110.811 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 8.5 m -125.59 -170.57 2.2 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.751 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.441 ' HA ' ' HA ' ' A' ' 47' ' ' PHE . 3.9 tttt -171.85 146.78 2.11 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.113 0.483 . . . . 0.0 110.794 -179.879 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.426 ' N ' ' HG2' ' A' ' 42' ' ' LYS . 7.2 mt-10 -131.45 169.57 13.45 Favored Pre-proline 0 C--N 1.324 -0.536 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.06 178.966 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_exo -51.61 -19.96 8.32 Favored 'Trans proline' 0 N--CA 1.463 -0.307 0 C-N-CA 121.776 1.65 . . . . 0.0 112.23 -179.416 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -85.73 -76.71 0.32 Allowed 'General case' 0 N--CA 1.445 -0.708 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.309 179.379 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . 0.418 ' HA3' ' HA ' ' A' ' 67' ' ' GLU . . . -142.99 -156.75 6.88 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.766 -179.336 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.441 ' HA ' ' HA ' ' A' ' 42' ' ' LYS . 22.3 m-85 -108.06 150.61 26.95 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-O 121.65 0.738 . . . . 0.0 112.57 -179.302 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.415 ' HA ' ' HA ' ' A' ' 65' ' ' LYS . 62.2 t -124.78 140.76 47.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 114.477 -1.238 . . . . 0.0 110.405 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -132.19 124.41 28.96 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.672 -0.24 . . . . 0.0 110.715 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -120.65 147.04 45.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.62 -0.264 . . . . 0.0 110.67 -179.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . 0.404 ' N ' HD13 ' A' ' 76' ' ' LEU . . . -145.39 142.03 28.98 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.899 0.381 . . . . 0.0 111.433 179.738 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.9 m -136.02 131.67 35.28 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.101 -0.5 . . . . 0.0 109.99 179.419 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 22.0 mt -132.85 137.52 53.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 121.0 0.429 . . . . 0.0 111.344 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -105.02 128.77 53.46 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.184 179.092 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.574 ' HB ' ' HD2' ' A' ' 56' ' ' PRO . 5.7 p -124.82 166.35 20.63 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.361 -179.895 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.574 ' HD2' ' HB ' ' A' ' 55' ' ' THR . 56.7 Cg_endo -72.79 -4.08 14.72 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.228 1.952 . . . . 0.0 112.529 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 81.1 m-20 -117.98 -4.3 11.08 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.406 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 154.1 -171.93 32.72 Favored Glycine 0 C--N 1.332 0.333 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.699 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 21.4 t -127.33 142.69 42.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.739 0.304 . . . . 0.0 111.093 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 30.1 mt -119.37 152.36 36.93 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.323 -0.398 . . . . 0.0 111.315 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.42 ' O ' ' NE2' ' A' ' 83' ' ' GLN . 21.6 t -141.56 143.61 27.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.815 179.735 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -151.0 156.9 42.11 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.13 0.491 . . . . 0.0 111.545 -179.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 10.6 m -145.16 154.78 42.79 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.718 -179.326 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -148.91 100.78 0.21 Allowed Glycine 0 C--N 1.332 0.357 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.699 179.4 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.415 ' HA ' ' HA ' ' A' ' 48' ' ' VAL . 8.8 mttt -102.52 44.57 1.0 Allowed 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -178.838 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 12.1 t-80 -76.36 155.3 34.23 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.78 0.324 . . . . 0.0 110.311 178.536 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.418 ' HA ' ' HA3' ' A' ' 46' ' ' GLY . 26.0 mt-10 -62.06 -26.22 68.14 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.759 0.314 . . . . 0.0 111.339 -179.871 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -97.28 121.95 39.76 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.044 0.449 . . . . 0.0 111.358 -179.395 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.6 ttt -47.51 -51.37 20.81 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.998 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 36.3 m-85 -65.91 -36.77 84.3 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.729 -179.023 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 94.2 m -64.23 -42.23 96.65 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.824 0.345 . . . . 0.0 110.658 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.51 -47.22 86.61 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.429 179.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 28.8 mt -59.71 -48.74 86.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.77 179.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 19.6 m-20 -64.03 -38.54 91.43 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.74 179.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -65.37 -45.66 83.22 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.606 179.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.404 HD13 ' N ' ' A' ' 51' ' ' ALA . 0.3 OUTLIER -54.22 -56.28 19.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.541 -0.3 . . . . 0.0 110.418 179.425 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 52.3 mt -57.86 -33.21 45.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 N-CA-C 110.227 -0.286 . . . . 0.0 110.227 179.231 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -58.63 -35.52 72.64 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.545 0.688 . . . . 0.0 109.781 178.641 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.4 mptp? -76.81 -27.77 55.31 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 114.83 -1.077 . . . . 0.0 110.138 179.409 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 96.3 mt -62.05 -50.14 73.19 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 177.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -62.79 -46.25 88.86 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 114.277 -1.329 . . . . 0.0 110.709 177.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.69 -34.14 75.23 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.07 -179.588 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.42 ' NE2' ' O ' ' A' ' 61' ' ' VAL . 36.9 mt-30 -75.39 -36.08 60.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.586 179.713 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.435 ' HB3' ' CD2' ' A' ' 29' ' ' TRP . 4.3 mt -64.66 -27.68 69.09 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.83 179.869 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -64.17 -26.02 68.34 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.729 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.442 ' HA ' ' CE1' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -72.71 -32.38 65.7 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.215 0.531 . . . . 0.0 110.85 -179.971 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.426 ' N ' ' HG3' ' A' ' 86' ' ' LYS . 5.0 mt -68.23 -8.5 39.69 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.373 -0.83 . . . . 0.0 112.055 -179.394 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -74.87 -41.91 58.89 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.107 0.479 . . . . 0.0 111.103 -179.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.461 ' O ' ' CB ' ' A' ' 90' ' ' LYS . 2.4 p-80 -85.17 -174.65 5.36 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.936 179.982 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.461 ' CB ' ' O ' ' A' ' 89' ' ' HIS . 11.9 tttt 86.28 146.4 0.06 Allowed 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.796 -179.756 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 141.25 109.9 0.8 Allowed Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.406 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -95.49 21.7 7.88 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.653 0.264 . . . . 0.0 111.198 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . 53.3 80.48 0.1 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.32 179.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -175.92 37.11 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.88 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 28.1 mtp85 -96.48 -32.76 12.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.922 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -95.92 80.28 3.32 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.098 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -82.84 -177.1 6.62 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.091 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -117.4 143.63 45.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.882 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.16 175.81 3.62 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.866 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 4.2 m -131.31 -49.82 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.16 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 3.0 tptt 179.94 38.93 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.831 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -144.41 117.08 8.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.902 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -173.97 87.08 0.05 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.062 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 31.9 m120 -119.55 -48.76 2.38 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.958 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 14.5 t80 -118.19 94.14 4.39 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.939 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 21.3 t -123.53 -60.53 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.093 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 60.71 110.17 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.888 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -122.2 -47.77 2.13 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.898 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 21.4 t -76.4 128.22 37.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.182 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -127.37 -68.12 0.8 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.863 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -150.88 92.45 1.83 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.91 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.243 -0.884 . . . . 0.0 110.929 179.958 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 1.2 m . . . . . 0 N--CA 1.486 1.36 0 CA-C-O 120.765 0.317 . . . . 0.0 111.213 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 5.9 tmm? -59.93 115.55 3.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.827 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -124.0 107.15 11.0 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.369 -179.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 40.0 mt -109.09 126.14 66.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.619 179.546 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -133.99 162.01 33.23 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.922 0.391 . . . . 0.0 111.147 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 21.6 p -162.72 137.58 6.69 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.298 -179.586 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.4 mmtt -101.82 34.65 2.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.116 -179.569 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -141.96 -45.3 0.34 Allowed 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.942 179.711 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.41 -177.81 4.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.84 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -106.8 163.95 12.51 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.435 179.817 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 3.8 mm -90.32 118.07 34.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 121.037 0.446 . . . . 0.0 111.009 -179.557 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 16.1 p -100.84 153.99 37.42 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.854 179.648 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_endo -57.37 -27.33 75.15 Favored 'Trans proline' 0 C--N 1.343 0.289 0 C-N-CA 122.417 2.078 . . . . 0.0 111.904 179.306 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -74.82 -40.41 61.08 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.934 0.397 . . . . 0.0 110.518 179.665 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 26.0 mt -73.14 -31.05 33.28 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 178.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.92 -46.24 58.36 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.399 178.73 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -67.61 -35.15 78.4 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.306 178.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.457 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 52.6 t60 -58.29 -63.56 1.22 Allowed 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 178.671 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 28.6 t -61.41 -42.9 95.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.528 -0.305 . . . . 0.0 110.258 178.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.641 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -56.62 -46.13 81.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.46 179.401 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.457 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 1.2 p30 -60.02 -31.88 70.36 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 120.923 0.392 . . . . 0.0 110.546 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 36.1 mmt180 -73.23 -27.11 61.41 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.613 179.66 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.641 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 2.0 mt -68.78 -49.82 55.47 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.118 0.485 . . . . 0.0 109.994 178.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.21 -26.42 66.36 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.016 179.459 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 19.8 tttt -77.22 -32.74 56.1 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.726 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 5.1 mt -80.73 53.84 1.99 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.845 0.355 . . . . 0.0 110.623 179.234 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -111.71 -11.14 14.02 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.083 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.96 -17.38 24.15 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.891 0.377 . . . . 0.0 111.058 179.742 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.441 ' CE3' ' HB3' ' A' ' 84' ' ' LEU . 63.2 m95 -84.03 -159.18 0.37 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.885 -179.74 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -133.6 -103.18 0.25 Allowed 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 178.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.39 -166.21 1.31 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.951 0.405 . . . . 0.0 111.263 179.504 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . 0.47 ' HA ' ' HB ' ' A' ' 55' ' ' THR . 0.4 OUTLIER 73.32 51.75 0.13 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.822 179.42 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 13.4 mt -162.68 100.48 1.02 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.66 178.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.481 HD11 HG21 ' A' ' 34' ' ' ILE . 8.8 mt -151.98 124.58 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 121.386 0.612 . . . . 0.0 111.669 -179.867 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 68.56 67.91 0.49 Allowed Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.15 179.564 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -74.14 133.75 18.41 Favored 'Trans proline' 0 N--CA 1.463 -0.268 0 C-N-CA 122.172 1.915 . . . . 0.0 112.279 -179.426 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -133.95 133.71 41.7 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 121.053 -0.259 . . . . 0.0 110.492 179.634 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.419 ' N ' ' CD1' ' A' ' 38' ' ' ILE . 3.1 mp -129.43 129.52 67.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.895 0.379 . . . . 0.0 111.155 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 3.9 mp -118.09 140.47 41.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.404 179.511 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -117.91 126.66 52.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.951 0.405 . . . . 0.0 111.161 -179.636 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -123.68 -172.88 2.62 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.379 179.638 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.456 ' CE ' ' CE2' ' A' ' 47' ' ' PHE . 13.4 tttm -172.95 146.73 1.56 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.197 0.522 . . . . 0.0 111.003 -179.803 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.406 ' HB3' ' HD2' ' A' ' 44' ' ' PRO . 43.7 mt-10 -132.33 166.79 26.12 Favored Pre-proline 0 C--N 1.323 -0.583 0 CA-C-N 115.428 -0.805 . . . . 0.0 109.153 179.054 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . 0.406 ' HD2' ' HB3' ' A' ' 43' ' ' GLU . 73.7 Cg_exo -50.05 -19.75 4.45 Favored 'Trans proline' 0 N--CA 1.464 -0.236 0 C-N-CA 121.678 1.586 . . . . 0.0 112.365 -179.529 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.75 -76.25 0.34 Allowed 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 115.575 -0.738 . . . . 0.0 110.328 179.317 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . 0.423 ' HA3' ' HA ' ' A' ' 67' ' ' GLU . . . -142.72 -158.74 7.66 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.751 -179.301 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.456 ' CE2' ' CE ' ' A' ' 42' ' ' LYS . 24.2 m-85 -107.35 151.19 25.83 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 121.577 0.703 . . . . 0.0 112.433 -179.298 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.441 ' HA ' ' HA ' ' A' ' 65' ' ' LYS . 78.7 t -126.0 139.78 50.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 114.712 -1.131 . . . . 0.0 110.577 -179.881 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.431 ' O ' ' HA ' ' A' ' 63' ' ' SER . . . -131.03 124.44 30.88 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.642 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -120.07 148.66 43.31 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.694 0.283 . . . . 0.0 110.737 -179.969 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . 0.426 ' N ' HD13 ' A' ' 76' ' ' LEU . . . -145.11 142.08 29.36 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.976 0.417 . . . . 0.0 111.399 179.925 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 4.0 m -133.84 132.03 39.92 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.78 179.466 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 13.2 mt -133.81 136.78 53.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.996 0.426 . . . . 0.0 111.516 -179.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -100.83 144.32 29.93 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.54 179.011 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.47 ' HB ' ' HA ' ' A' ' 32' ' ' HIS . 24.4 p -136.3 168.68 16.08 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.735 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_exo -71.84 -12.98 29.15 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.843 2.362 . . . . 0.0 112.705 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -130.15 21.36 5.3 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 112.038 0.384 . . . . 0.0 112.038 -179.368 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 150.52 -164.79 29.9 Favored Glycine 0 C--N 1.33 0.223 0 C-N-CA 120.082 -1.056 . . . . 0.0 113.334 179.682 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 12.8 t -141.7 146.55 22.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.687 0.279 . . . . 0.0 110.921 -179.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.8 mt -119.11 147.44 44.16 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.871 0.367 . . . . 0.0 111.271 -179.679 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 9.2 p -141.18 147.37 22.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.018 179.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -155.23 154.41 32.15 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.078 0.466 . . . . 0.0 111.333 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' SER . . . . . 0.431 ' HA ' ' O ' ' A' ' 49' ' ' ALA . 3.1 p -146.56 153.99 41.0 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.737 -179.41 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -147.47 107.03 0.37 Allowed Glycine 0 C--N 1.333 0.386 0 N-CA-C 111.496 -0.642 . . . . 0.0 111.496 179.199 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.441 ' HA ' ' HA ' ' A' ' 48' ' ' VAL . 13.6 mtpt -107.24 44.75 1.04 Allowed 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 -178.701 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.462 ' CG ' ' CG2' ' A' ' 71' ' ' THR . 12.8 t-80 -76.77 155.65 32.97 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.81 0.338 . . . . 0.0 110.292 178.688 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.423 ' HA ' ' HA3' ' A' ' 46' ' ' GLY . 1.3 mm-40 -61.64 -26.29 67.91 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.823 0.344 . . . . 0.0 111.185 179.819 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -98.09 123.69 42.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.367 -179.558 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 6.1 ttt -47.63 -47.43 29.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.773 -0.648 . . . . 0.0 111.796 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -66.46 -38.71 87.95 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.861 -179.016 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.462 ' CG2' ' CG ' ' A' ' 66' ' ' HIS . 87.8 m -63.84 -42.01 97.69 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.707 0.289 . . . . 0.0 110.76 -179.749 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.64 -49.0 78.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.541 179.678 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 23.1 mt -59.91 -47.54 91.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.788 179.715 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -63.39 -37.74 88.44 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.604 179.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -65.64 -44.1 87.46 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.575 179.57 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.426 HD13 ' N ' ' A' ' 51' ' ' ALA . 0.3 OUTLIER -54.49 -56.8 15.1 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.269 179.323 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 14.1 mm -57.66 -30.31 36.78 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.493 -0.322 . . . . 0.0 110.133 179.044 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -58.32 -36.32 73.2 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.474 0.654 . . . . 0.0 109.694 178.534 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 5.7 mmtm -76.29 -30.06 57.61 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.853 -1.067 . . . . 0.0 110.375 179.365 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 31.4 mt -60.33 -49.68 76.62 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 177.477 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -61.44 -43.16 99.36 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 114.207 -1.361 . . . . 0.0 110.091 177.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.42 -30.6 71.34 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.55 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -76.35 -40.21 51.85 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.015 0.436 . . . . 0.0 110.48 179.486 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.441 ' HB3' ' CE3' ' A' ' 29' ' ' TRP . 6.5 mt -64.98 -30.76 71.77 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.646 179.684 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 -64.3 -52.66 57.45 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.551 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.428 ' HA ' ' CE1' ' A' ' 89' ' ' HIS . 6.9 mmtm -71.41 -21.17 62.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.48 179.52 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.439 ' CD2' ' CE1' ' A' ' 32' ' ' HIS . 2.3 tm? -69.77 -30.72 68.36 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.644 179.701 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -76.13 -12.88 60.19 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.555 -179.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.428 ' CE1' ' HA ' ' A' ' 86' ' ' LYS . 6.7 m170 -85.17 -55.54 3.99 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.861 0.363 . . . . 0.0 110.959 179.812 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -70.34 65.76 0.29 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.947 -179.726 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 146.54 119.08 1.15 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.72 -0.753 . . . . 0.0 112.395 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -87.77 54.19 3.03 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.884 0.373 . . . . 0.0 111.0 -179.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . 59.72 168.92 0.07 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.27 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 8.1 ttt180 -103.03 160.76 14.34 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.86 179.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 1.1 tpt180 -102.88 -179.86 4.08 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.853 -179.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -72.99 -32.8 65.4 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.046 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -159.36 -45.07 0.05 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.131 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 60.55 167.54 0.08 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.832 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 4.8 t 60.94 -177.32 0.11 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.881 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 9.4 p -131.59 154.7 40.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.085 179.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 7.3 mttp -97.88 -48.35 5.21 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.811 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -139.33 -65.36 0.48 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.914 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -171.74 -55.34 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.019 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 -154.07 -64.86 0.14 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.951 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -68.96 105.62 2.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.889 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 27.2 m -104.62 115.35 46.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.195 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -117.95 169.68 9.45 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.845 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -135.59 -47.34 0.68 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.866 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 30.1 t -126.04 143.27 40.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.055 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -117.96 98.36 6.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.817 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -103.49 130.08 50.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.884 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.168 -0.92 . . . . 0.0 110.908 179.982 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 1.3 p . . . . . 0 N--CA 1.485 1.317 0 CA-C-O 120.82 0.343 . . . . 0.0 111.087 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 8.4 tmm? -66.24 110.79 3.16 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.886 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -103.0 124.87 49.33 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.19 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 34.5 mt -109.89 124.01 66.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.873 179.786 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.8 p -134.09 156.7 47.81 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.059 179.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 22.0 p -164.37 139.79 5.89 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.614 -179.754 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 6.2 mtmp? -101.55 35.5 2.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.809 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -141.94 -50.23 0.39 Allowed 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.755 179.823 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 17.5 mtm -119.01 177.9 4.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.857 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 -104.52 164.96 11.38 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.736 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.8 mm -90.02 112.35 24.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 121.088 0.471 . . . . 0.0 111.009 -179.678 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 19.3 p -98.92 148.69 34.91 Favored Pre-proline 0 C--N 1.326 -0.419 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.018 179.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_exo -55.3 -21.06 27.53 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.325 2.017 . . . . 0.0 111.69 179.148 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -76.12 -42.81 45.82 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.051 0.453 . . . . 0.0 110.317 179.255 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 24.6 mt -72.41 -29.02 29.92 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.34 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.489 178.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 79.4 mtt180 -74.67 -45.19 46.19 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.575 -0.739 . . . . 0.0 109.74 178.773 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 3.3 tm0? -67.38 -38.89 85.44 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.564 179.022 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.497 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 78.3 t60 -59.75 -60.58 3.61 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 178.975 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.427 ' O ' ' HG ' ' A' ' 23' ' ' LEU . 15.1 t -60.45 -46.94 94.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 C-N-CA 121.014 -0.274 . . . . 0.0 110.31 178.733 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.685 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -58.1 -41.58 83.81 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.887 179.7 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.497 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 0.9 OUTLIER -59.59 -34.37 72.64 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.006 0.431 . . . . 0.0 110.064 179.9 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 9.0 mmt180 -74.81 -25.98 59.41 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.747 179.551 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.685 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 10.1 mt -68.85 -57.41 5.59 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.285 0.564 . . . . 0.0 110.521 179.388 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.15 -25.76 65.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.291 -0.868 . . . . 0.0 111.566 -179.777 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 10.1 tppt? -78.64 -32.57 47.37 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.039 0.447 . . . . 0.0 110.29 179.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.466 ' CD2' ' CD1' ' A' ' 29' ' ' TRP . 44.4 mt -80.15 63.81 4.77 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.836 -179.957 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -64.8 -42.44 95.02 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.959 -179.534 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.02 39.61 0.94 Allowed 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 120.839 0.352 . . . . 0.0 111.592 -179.472 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.466 ' CD1' ' CD2' ' A' ' 26' ' ' LEU . 27.1 m95 -148.26 -77.77 0.16 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.763 -179.242 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 18.5 mt-30 -65.22 102.27 0.63 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.708 0.289 . . . . 0.0 110.58 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -159.01 -43.9 0.06 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.976 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -94.17 28.56 2.45 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.849 179.771 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.43 ' HB3' ' CG2' ' A' ' 53' ' ' ILE . 35.3 mt -102.99 156.43 17.68 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.422 179.743 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 28.9 mt -140.34 95.81 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 120.803 0.335 . . . . 0.0 111.498 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 59.74 70.15 1.12 Allowed Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.272 179.746 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -73.9 163.83 36.05 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.557 2.171 . . . . 0.0 111.896 179.463 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 1.5 t-160 -137.36 131.11 31.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.043 0.449 . . . . 0.0 111.369 -179.596 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.402 ' CD1' ' CB ' ' A' ' 51' ' ' ALA . 8.5 mm -121.0 134.31 64.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.703 179.766 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 23.3 mt -120.85 142.27 37.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.026 -179.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 10.3 mt -121.29 128.31 52.21 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.78 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.3 m -124.65 -171.53 2.37 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.492 179.813 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.416 ' HG3' ' CD2' ' A' ' 47' ' ' PHE . 7.5 ttpp -160.41 141.18 11.88 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.339 0.59 . . . . 0.0 111.353 -179.739 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -131.49 157.47 78.04 Favored Pre-proline 0 C--N 1.322 -0.593 0 CA-C-N 115.089 -0.959 . . . . 0.0 109.27 179.25 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_exo -52.41 -24.49 21.8 Favored 'Trans proline' 0 N--CA 1.464 -0.235 0 C-N-CA 121.808 1.672 . . . . 0.0 112.371 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -89.48 -6.83 56.1 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.433 -0.803 . . . . 0.0 112.766 -179.081 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 150.12 -163.87 29.55 Favored Glycine 0 C--O 1.224 -0.493 0 C-N-CA 120.239 -0.982 . . . . 0.0 112.16 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.416 ' CD2' ' HG3' ' A' ' 42' ' ' LYS . 18.7 m-85 -109.19 154.02 22.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.529 0.68 . . . . 0.0 111.959 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 74.6 t -127.72 139.73 51.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 114.858 -1.065 . . . . 0.0 111.042 -179.204 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -130.94 122.83 27.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.38 179.481 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -118.64 149.48 41.32 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.709 0.29 . . . . 0.0 110.807 -179.813 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . 0.402 ' CB ' ' CD1' ' A' ' 38' ' ' ILE . . . -144.31 139.38 28.52 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.234 179.787 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.7 m -133.78 131.44 39.33 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 179.393 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.43 ' CG2' ' HB3' ' A' ' 33' ' ' LEU . 19.0 mt -133.05 136.6 55.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 121.146 0.498 . . . . 0.0 111.729 -179.226 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -101.79 119.06 38.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.688 179.38 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 9.3 p -112.46 155.89 43.06 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.529 179.717 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -63.01 -14.08 39.24 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.521 2.148 . . . . 0.0 112.576 -179.806 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 61.8 m-80 -120.38 22.23 11.38 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 111.709 0.262 . . . . 0.0 111.709 -179.605 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 139.33 -167.14 25.32 Favored Glycine 0 N--CA 1.453 -0.212 0 C-N-CA 120.446 -0.883 . . . . 0.0 112.85 179.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 16.6 t -137.59 142.33 36.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.82 0.343 . . . . 0.0 111.04 -179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.6 mp -116.34 153.54 31.81 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.104 -179.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 21.6 t -140.26 147.15 23.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.067 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -153.77 151.69 29.86 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.023 0.439 . . . . 0.0 111.576 -179.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -145.18 155.24 43.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.664 -179.342 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -148.67 104.53 0.28 Allowed Glycine 0 C--N 1.333 0.367 0 N-CA-C 111.399 -0.681 . . . . 0.0 111.399 179.32 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 10.7 mttm -106.87 45.5 0.98 Allowed 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -178.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.416 ' CG ' HG22 ' A' ' 71' ' ' THR . 14.6 t-80 -75.47 156.26 35.4 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 178.474 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -59.97 -27.56 66.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.752 0.311 . . . . 0.0 111.218 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -97.97 119.89 37.41 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.985 0.421 . . . . 0.0 111.475 -179.343 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.2 ttt -47.73 -46.27 29.71 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.502 179.732 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 45.6 m-85 -66.57 -39.51 88.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.127 -179.556 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.416 HG22 ' CG ' ' A' ' 66' ' ' HIS . 92.4 m -65.42 -38.56 90.27 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.668 179.87 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.03 -50.64 71.23 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.825 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 7.3 mt -61.34 -42.01 92.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.698 0.285 . . . . 0.0 110.249 179.518 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -64.53 -40.74 96.17 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.13 0.491 . . . . 0.0 109.965 178.862 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -65.41 -44.58 87.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.57 179.438 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -52.38 -59.91 3.85 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 179.119 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 1.9 mm -55.92 -28.7 24.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 178.503 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.52 -41.69 90.55 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.395 0.617 . . . . 0.0 109.433 178.243 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.32 -30.87 65.17 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.987 -1.006 . . . . 0.0 110.191 178.898 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 96.9 mt -62.74 -46.51 87.72 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 177.43 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.27 -45.7 92.4 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 114.674 -1.148 . . . . 0.0 110.253 177.556 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.97 -35.71 81.59 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.529 -179.528 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -73.65 -46.87 44.08 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.893 0.378 . . . . 0.0 110.361 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.429 ' CB ' ' HE3' ' A' ' 29' ' ' TRP . 1.5 mt -64.69 -27.67 69.08 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.405 179.387 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . 0.406 ' O ' ' HG3' ' A' ' 88' ' ' GLN . 54.7 t30 -61.15 -46.98 88.32 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.151 -179.575 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.455 ' O ' ' CD2' ' A' ' 89' ' ' HIS . 5.4 mtmm -75.7 -24.04 56.2 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.976 179.649 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 3.2 tt -72.38 -12.84 61.29 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.161 -0.472 . . . . 0.0 112.092 -179.394 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . 0.406 ' HG3' ' O ' ' A' ' 85' ' ' ASN . 2.7 pp0? -76.02 -45.2 35.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.921 0.391 . . . . 0.0 111.925 -179.088 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.455 ' CD2' ' O ' ' A' ' 86' ' ' LYS . 1.6 p-80 -87.85 164.43 15.9 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.234 -179.913 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -170.33 -43.87 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.95 179.652 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 171.03 -162.76 35.69 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.451 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 60.98 95.92 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.847 0.356 . . . . 0.0 110.929 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . 62.65 122.49 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.122 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 12.8 ptp180 -59.79 -31.99 70.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.87 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -69.88 131.36 44.32 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.806 -179.975 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -67.17 113.39 5.08 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.193 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -78.48 153.62 31.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.109 -179.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 18.7 m 60.33 163.06 0.06 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.903 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 60.39 -173.41 0.12 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.916 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 21.5 t 63.15 146.65 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.156 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 1.3 mtpt -155.91 173.55 16.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.945 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -126.25 89.26 2.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.884 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -69.11 -176.37 0.88 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.131 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 21.0 t30 60.44 168.02 0.08 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.905 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 36.4 p90 -110.71 118.29 35.77 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.896 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 9.8 p -124.99 155.73 33.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.056 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.31 124.47 23.93 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.872 179.891 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -152.18 35.99 0.53 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.842 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 11.4 p -124.3 114.23 40.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.087 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -110.73 153.19 25.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.879 -179.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 27.3 mt-10 -104.48 176.63 5.09 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.882 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.294 -0.86 . . . . 0.0 110.865 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.487 1.402 0 CA-C-O 120.856 0.36 . . . . 0.0 111.193 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 6.1 tmm? -55.42 121.07 8.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.909 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -120.34 124.38 45.41 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.165 -179.863 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 49.2 mt -120.39 125.95 74.72 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.849 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -132.87 160.66 36.33 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.986 179.729 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 21.9 p -163.35 142.02 8.14 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.745 -179.468 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.7 mmtm -103.92 16.15 26.98 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.353 -179.795 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 17.6 mt-30 -141.92 23.02 2.09 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 120.791 0.329 . . . . 0.0 111.031 179.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 176.46 -178.26 0.15 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.654 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -121.12 163.04 19.02 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.784 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 3.8 mm -91.18 118.19 35.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.937 0.398 . . . . 0.0 110.877 -179.748 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 19.2 p -100.21 159.26 30.27 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.871 179.739 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_exo -62.58 -13.3 32.73 Favored 'Trans proline' 0 C--N 1.344 0.291 0 C-N-CA 122.611 2.207 . . . . 0.0 112.215 179.479 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -90.23 -38.59 13.33 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.025 0.441 . . . . 0.0 110.678 179.537 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 19.3 mt -72.89 -32.38 39.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.758 -0.656 . . . . 0.0 109.513 179.194 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.41 ' CG ' ' N ' ' A' ' 17' ' ' GLN . 23.2 ptt180 -71.54 -45.73 61.53 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.538 178.86 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.41 ' N ' ' CG ' ' A' ' 16' ' ' ARG . 6.0 tp-100 -67.02 -35.85 80.82 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.492 179.014 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.467 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 68.0 t60 -58.3 -64.03 1.06 Allowed 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 178.682 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 15.2 t -61.43 -45.32 98.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.663 178.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.623 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -55.52 -49.28 73.04 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.678 179.751 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.467 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 3.0 p30 -59.13 -29.24 67.26 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.822 0.344 . . . . 0.0 110.641 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 41.8 mmt180 -74.77 -28.03 60.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.528 179.339 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.623 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 1.3 mt -68.85 -48.55 63.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.964 0.412 . . . . 0.0 110.102 178.794 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.97 -26.25 65.86 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.793 179.473 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 15.6 tttp -78.51 -32.04 47.89 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.649 179.492 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 5.4 mt -80.31 57.13 2.69 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.713 179.695 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -103.25 -3.24 25.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.515 -179.811 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.423 ' HE3' ' CZ2' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -66.71 -14.11 62.13 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.84 0.353 . . . . 0.0 111.28 179.925 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.447 ' CD2' ' HB3' ' A' ' 84' ' ' LEU . 49.8 m95 -84.96 -51.9 6.37 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.019 0.437 . . . . 0.0 110.895 179.882 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 66.99 73.36 0.35 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.133 179.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 9.1 t -160.06 149.69 17.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.168 0.509 . . . . 0.0 111.009 179.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 43.3 m-70 -53.22 160.61 1.05 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.484 -0.78 . . . . 0.0 112.321 -178.792 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 72.0 mt -155.4 49.86 0.55 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.07 -0.968 . . . . 0.0 109.357 179.564 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 2.9 mt -46.62 92.44 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 121.997 0.903 . . . . 0.0 112.783 -178.567 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 51.44 84.72 0.2 Allowed Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 113.795 -1.548 . . . . 0.0 113.8 177.556 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -86.3 132.5 3.76 Favored 'Trans proline' 0 N--CA 1.454 -0.847 0 C-N-CA 122.686 2.257 . . . . 0.0 109.92 177.11 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -98.63 130.47 45.15 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -177.877 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 5.5 mm -121.48 132.65 70.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.342 -0.844 . . . . 0.0 109.766 178.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 26.6 mt -119.96 148.08 23.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 121.0 0.428 . . . . 0.0 111.868 -179.232 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.6 mt -123.38 127.18 48.1 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.629 179.59 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -124.8 -170.76 2.22 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.725 -179.889 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.458 ' HG2' ' N ' ' A' ' 43' ' ' GLU . 1.6 tttp -170.5 145.05 2.53 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.304 0.574 . . . . 0.0 110.932 -179.786 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.458 ' N ' ' HG2' ' A' ' 42' ' ' LYS . 3.3 mm-40 -130.24 163.87 44.88 Favored Pre-proline 0 C--N 1.323 -0.576 0 CA-C-N 115.457 -0.792 . . . . 0.0 108.927 178.871 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . 0.444 ' HD2' ' HB3' ' A' ' 43' ' ' GLU . 5.0 Cg_endo -48.14 -21.96 3.32 Favored 'Trans proline' 0 N--CA 1.463 -0.287 0 C-N-CA 122.073 1.848 . . . . 0.0 112.166 -179.359 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -83.73 -75.15 0.34 Allowed 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.212 179.291 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . 0.437 ' HA3' ' HA ' ' A' ' 67' ' ' GLU . . . -143.89 -156.67 6.88 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.814 -179.31 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.453 ' CE2' ' HG3' ' A' ' 42' ' ' LYS . 22.8 m-85 -107.69 151.38 25.75 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.654 0.74 . . . . 0.0 112.476 -179.32 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.427 ' HA ' ' HA ' ' A' ' 65' ' ' LYS . 78.6 t -124.46 140.93 46.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 114.525 -1.216 . . . . 0.0 110.424 -179.875 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.429 ' O ' ' HA ' ' A' ' 63' ' ' SER . . . -132.08 125.1 30.55 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.64 -0.255 . . . . 0.0 110.922 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 -117.77 148.58 41.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.465 179.652 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . 0.429 ' N ' HD11 ' A' ' 76' ' ' LEU . . . -144.58 142.52 30.23 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.968 0.413 . . . . 0.0 111.771 -179.802 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.1 m -135.26 131.32 36.45 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.839 179.334 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 21.3 mt -133.35 138.84 50.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.119 0.485 . . . . 0.0 111.842 -179.159 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 18.9 m120 -102.28 119.18 38.37 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.648 179.3 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.436 ' HB ' ' HD2' ' A' ' 56' ' ' PRO . 6.1 p -113.82 162.35 23.14 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.295 179.673 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.436 ' HD2' ' HB ' ' A' ' 55' ' ' THR . 68.9 Cg_endo -76.22 -3.17 13.49 Favored 'Trans proline' 0 N--CA 1.463 -0.318 0 C-N-CA 122.211 1.94 . . . . 0.0 112.517 -179.857 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -129.63 23.47 5.44 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.202 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 140.4 -167.4 25.52 Favored Glycine 0 C--N 1.33 0.239 0 C-N-CA 120.54 -0.838 . . . . 0.0 112.778 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 21.3 t -131.55 147.27 32.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.766 0.317 . . . . 0.0 111.11 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 13.0 mt -120.65 141.97 49.87 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.29 -179.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 21.7 t -141.21 139.96 32.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.758 179.74 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -151.42 159.5 44.2 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.296 0.569 . . . . 0.0 111.857 -179.557 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' SER . . . . . 0.429 ' HA ' ' O ' ' A' ' 49' ' ' ALA . 2.4 p -145.58 154.89 42.66 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.281 -0.872 . . . . 0.0 111.678 -179.306 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -148.31 105.05 0.3 Allowed Glycine 0 C--N 1.332 0.358 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.551 179.341 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.427 ' HA ' ' HA ' ' A' ' 48' ' ' VAL . 5.3 mttp -105.97 44.9 1.0 Allowed 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 112.401 0.519 . . . . 0.0 112.401 -178.683 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.414 ' ND1' ' CG2' ' A' ' 71' ' ' THR . 12.6 t-80 -76.64 155.69 33.26 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.757 0.313 . . . . 0.0 110.309 178.582 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.437 ' HA ' ' HA3' ' A' ' 46' ' ' GLY . 10.8 mt-10 -61.63 -26.34 67.94 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.787 0.327 . . . . 0.0 111.223 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -97.61 122.63 40.91 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.083 0.468 . . . . 0.0 111.475 -179.364 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -47.71 -49.91 26.59 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.772 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 40.3 m-85 -66.19 -37.45 85.63 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.711 -179.087 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.414 ' CG2' ' ND1' ' A' ' 66' ' ' HIS . 94.1 m -64.22 -41.61 96.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.774 0.321 . . . . 0.0 110.655 -179.859 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.83 -47.91 82.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.491 179.455 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 31.0 mt -60.19 -48.08 89.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.624 179.715 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -64.05 -39.78 94.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.752 179.767 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -65.12 -44.34 89.03 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.536 179.678 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.429 HD11 ' N ' ' A' ' 51' ' ' ALA . 0.3 OUTLIER -54.21 -57.6 10.54 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.504 -0.317 . . . . 0.0 110.373 179.397 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 61.6 mt -56.63 -30.88 33.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 N-CA-C 110.162 -0.311 . . . . 0.0 110.162 179.218 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -58.66 -36.55 74.32 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.513 0.673 . . . . 0.0 109.571 178.403 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.6 -28.04 58.75 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.8 -1.091 . . . . 0.0 110.024 179.258 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 77.7 mt -62.79 -49.6 74.34 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 177.438 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -62.68 -46.13 89.6 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 114.293 -1.321 . . . . 0.0 110.744 177.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.74 -37.53 86.93 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.939 -179.433 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 44.3 mt-30 -75.71 -37.7 59.2 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.884 0.373 . . . . 0.0 110.803 179.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.447 ' HB3' ' CD2' ' A' ' 29' ' ' TRP . 2.2 mt -64.24 -25.37 68.03 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.695 179.668 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -64.15 -28.0 69.46 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.538 179.661 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 16.2 mmtt -72.66 -22.37 60.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.102 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 9.9 mt -68.75 -53.89 19.21 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.873 0.368 . . . . 0.0 110.568 179.827 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 61.5 mt-30 -77.16 -8.84 58.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.094 179.581 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 7.2 m-70 58.57 177.71 0.07 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.033 179.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 2.0 mmmp? -169.6 -43.77 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.811 179.828 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -115.3 -32.12 1.88 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.518 179.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -121.13 136.56 54.95 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.804 0.335 . . . . 0.0 110.863 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -171.1 152.74 3.53 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.165 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.09 140.55 18.76 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.869 -179.952 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.58 143.97 25.99 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.868 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -93.36 -177.66 4.5 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.106 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -155.14 155.06 33.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.123 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -151.6 -68.17 0.17 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.917 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 19.8 m 63.2 124.01 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.97 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 14.7 p -130.53 16.42 2.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.401 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 1.2 mmpt? 60.04 111.47 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.809 0.337 . . . . 0.0 110.959 179.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -157.52 106.84 2.14 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.905 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -138.61 -51.41 0.57 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.167 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 11.5 p30 -60.14 173.46 0.64 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.928 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 17.2 m-85 -159.63 -177.96 6.75 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.854 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 13.6 p 43.52 45.61 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.18 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.62 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 58.2 mt-10 -58.02 -29.3 65.22 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.089 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -60.46 168.66 2.02 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.922 179.932 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 11.2 p -150.92 136.99 12.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.067 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 7.7 tm-20 60.66 109.79 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.888 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -132.3 168.22 18.48 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.828 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.178 -0.915 . . . . 0.0 110.953 -179.989 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 85.9 m . . . . . 0 N--CA 1.486 1.365 0 CA-C-O 120.856 0.36 . . . . 0.0 111.216 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 3.2 mpp? -113.01 156.46 23.03 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.916 179.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -122.91 114.27 20.22 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.26 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 36.4 mt -123.55 123.86 68.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.68 179.617 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -134.99 157.5 46.78 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.998 0.428 . . . . 0.0 111.366 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 22.4 p -164.69 139.59 5.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.436 -179.761 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -102.03 25.31 8.9 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.188 -179.736 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -140.89 15.53 2.3 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.164 179.648 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER 173.72 -177.33 0.08 Allowed 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.984 0.421 . . . . 0.0 110.74 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -110.69 172.51 6.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.651 179.838 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.8 mm -91.01 113.22 26.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 121.009 0.433 . . . . 0.0 111.173 -179.579 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 12.5 p -98.83 157.39 34.24 Favored Pre-proline 0 C--N 1.327 -0.405 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.959 179.809 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -62.55 -13.51 33.9 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.579 2.186 . . . . 0.0 111.984 179.204 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -86.1 -41.01 15.11 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.058 0.456 . . . . 0.0 110.428 179.397 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 24.5 mt -72.7 -29.29 29.72 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.29 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.813 179.265 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 2.2 ptm180 -74.99 -43.4 54.15 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.868 -0.605 . . . . 0.0 109.544 178.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -67.39 -37.94 83.91 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.696 178.922 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.476 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 82.1 t60 -60.63 -53.65 54.86 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 178.55 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.772 ' O ' ' HG3' ' A' ' 22' ' ' ARG . 23.9 t -62.55 -49.28 84.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.209 178.312 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.542 ' HA ' ' CG ' ' A' ' 23' ' ' LEU . . . -55.65 -37.91 68.85 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.759 -0.376 . . . . 0.0 111.875 179.762 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.476 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 0.9 OUTLIER -64.37 -32.53 74.18 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.37 -0.532 . . . . 0.0 110.477 179.335 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.772 ' HG3' ' O ' ' A' ' 19' ' ' VAL . 0.0 OUTLIER -77.9 -39.72 42.14 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.914 -0.585 . . . . 0.0 112.486 -179.283 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.542 ' CG ' ' HA ' ' A' ' 20' ' ' ALA . 0.0 OUTLIER -65.24 -48.51 73.04 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 120.034 -0.666 . . . . 0.0 110.843 -179.463 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.31 -24.79 66.68 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.15 179.556 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 2.9 tppp? -79.14 -34.29 43.39 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.854 179.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.414 HD21 ' CD1' ' A' ' 29' ' ' TRP . 0.8 OUTLIER -81.22 56.97 3.02 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.908 -179.991 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -109.86 -12.28 14.6 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.513 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.416 ' HE3' ' CD2' ' A' ' 29' ' ' TRP . 0.2 OUTLIER -66.08 -14.11 61.18 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.735 0.302 . . . . 0.0 111.483 -179.922 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.419 ' CE3' ' HB3' ' A' ' 84' ' ' LEU . 66.1 m95 -84.92 165.02 17.99 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.095 -179.827 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . 0.412 ' O ' ' CG2' ' A' ' 31' ' ' THR . 6.9 mp0 -84.2 -130.59 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.216 179.637 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.412 ' CG2' ' O ' ' A' ' 30' ' ' GLN . 15.3 t 45.0 -166.97 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.146 0 CA-C-O 120.836 0.35 . . . . 0.0 111.21 179.832 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 97.4 m-70 -144.38 -41.04 0.26 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.224 -179.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 66.15 147.63 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.203 -179.531 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 25.0 mt -138.47 111.07 6.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 121.335 0.588 . . . . 0.0 112.193 -179.604 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 25.1 m120 62.88 81.19 0.23 Allowed Pre-proline 0 C--N 1.327 -0.384 0 CA-C-N 115.091 -0.958 . . . . 0.0 112.312 178.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -81.89 145.08 14.0 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.988 2.459 . . . . 0.0 111.433 178.71 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 2.2 t-160 -134.4 130.97 37.65 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.125 0.488 . . . . 0.0 111.635 -179.455 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 9.1 mm -120.13 133.76 65.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.388 179.495 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 2.1 mp -119.11 146.26 24.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.002 -179.815 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 45.8 mt -124.13 126.85 46.88 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.888 179.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -123.65 -173.93 2.86 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.398 179.696 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.414 ' HG3' ' CD2' ' A' ' 47' ' ' PHE . 15.1 tttt -159.7 140.66 12.45 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.425 0.631 . . . . 0.0 111.489 -179.667 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -131.58 156.82 79.62 Favored Pre-proline 0 C--N 1.323 -0.566 0 CA-C-N 114.934 -1.03 . . . . 0.0 109.195 179.15 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_exo -52.12 -24.47 20.15 Favored 'Trans proline' 0 N--CA 1.465 -0.183 0 C-N-CA 121.854 1.703 . . . . 0.0 112.418 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -89.64 -6.71 55.93 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.499 -0.773 . . . . 0.0 112.833 -179.178 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 149.94 -164.35 29.57 Favored Glycine 0 C--O 1.224 -0.503 0 C-N-CA 120.214 -0.993 . . . . 0.0 112.154 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.414 ' CD2' ' HG3' ' A' ' 42' ' ' LYS . 18.3 m-85 -108.35 153.63 22.99 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.57 0.7 . . . . 0.0 111.854 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 54.1 t -127.36 140.7 48.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 114.82 -1.082 . . . . 0.0 111.023 -179.281 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -131.84 124.11 28.92 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.677 179.682 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 67.8 m-20 -118.89 147.33 44.11 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.685 0.278 . . . . 0.0 110.743 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -144.97 141.19 28.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.875 0.369 . . . . 0.0 111.547 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 6.4 m -135.29 133.49 38.94 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.361 179.576 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 1.1 mm -132.31 134.38 59.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.843 0.354 . . . . 0.0 111.13 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 23.7 m120 -103.24 118.29 36.45 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.438 179.026 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 30.3 p -113.61 153.98 45.73 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.877 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_exo -61.87 -15.46 43.02 Favored 'Trans proline' 0 C--N 1.343 0.263 0 C-N-CA 122.564 2.176 . . . . 0.0 112.655 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 -118.89 21.98 12.17 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.616 -0.265 . . . . 0.0 111.691 -179.546 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 141.84 -165.46 26.52 Favored Glycine 0 C--N 1.33 0.243 0 C-N-CA 120.376 -0.916 . . . . 0.0 113.053 179.756 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 12.5 t -142.24 142.29 27.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.822 0.344 . . . . 0.0 111.02 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -117.64 148.99 41.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.192 -179.792 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 12.4 t -138.87 145.6 27.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.874 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -153.43 150.97 29.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.168 0.509 . . . . 0.0 111.604 -179.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 11.5 p -143.04 158.7 43.36 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.643 -179.41 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -153.46 109.77 0.42 Allowed Glycine 0 C--N 1.33 0.232 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.61 179.639 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 60.7 mttt -110.68 45.14 1.17 Allowed 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -178.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 12.3 t-80 -75.79 156.36 34.61 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 110.207 -0.294 . . . . 0.0 110.207 178.543 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -61.1 -26.7 67.84 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.72 0.295 . . . . 0.0 111.295 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . 0.401 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 12.0 t70 -98.53 120.8 39.57 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.023 0.439 . . . . 0.0 111.371 -179.378 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 13.2 ttt -48.04 -50.72 26.94 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.953 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -65.56 -40.23 92.6 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.268 -179.296 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.401 ' HB ' ' HB3' ' A' ' 68' ' ' ASP . 37.9 m -64.74 -40.44 95.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.801 0.334 . . . . 0.0 110.679 179.891 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.17 -49.36 76.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.648 179.506 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 12.9 mt -60.4 -45.1 97.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.878 0.37 . . . . 0.0 110.266 179.512 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -64.45 -37.82 88.85 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.261 179.264 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -65.85 -42.23 90.71 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.183 179.233 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -53.57 -56.24 18.78 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 178.4 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.448 ' CD1' ' HG2' ' A' ' 22' ' ' ARG . 37.4 mt -56.79 -30.63 33.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.17 178.493 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -57.93 -35.77 71.55 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.548 0.69 . . . . 0.0 109.305 178.241 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.3 mptp? -78.92 -31.27 45.16 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 114.7 -1.136 . . . . 0.0 110.208 179.065 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 76.4 mt -63.07 -50.39 70.76 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 177.775 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -60.46 -47.6 85.42 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 114.942 -1.027 . . . . 0.0 110.22 177.522 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 59.7 mtt180 -62.96 -24.57 67.95 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.819 179.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 7.2 mt-30 -75.44 -44.24 45.4 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.615 179.757 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.419 ' HB3' ' CE3' ' A' ' 29' ' ' TRP . 28.3 mt -64.79 -27.4 68.86 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.835 179.866 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -63.55 -33.06 74.76 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.018 0.437 . . . . 0.0 110.549 179.75 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 18.6 mmtt -73.31 -25.95 60.86 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.966 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 3.3 tt -69.45 -16.62 63.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.196 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 34.8 mt-30 -76.52 -5.72 48.77 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.477 -179.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.433 ' O ' ' CB ' ' A' ' 90' ' ' LYS . 5.9 p80 -154.8 -177.04 6.23 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.729 0.299 . . . . 0.0 110.903 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.433 ' CB ' ' O ' ' A' ' 89' ' ' HIS . 1.2 ttpm? 83.41 89.46 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.829 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -75.87 -29.24 59.44 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.493 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 60.93 -177.89 0.11 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.826 0.346 . . . . 0.0 110.932 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -134.83 167.16 21.38 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.124 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -92.39 155.23 18.03 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.919 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 10.8 mtt-85 -135.62 -56.58 0.79 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.925 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -146.53 134.25 21.12 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.138 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -65.37 -56.07 14.61 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.099 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.8 133.36 35.26 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.882 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -177.56 -41.59 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.872 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 28.4 t -63.23 -67.16 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.12 -179.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 16.7 mttm -105.8 115.52 30.39 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.947 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -85.79 -172.74 4.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.859 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -134.55 -46.16 0.75 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.131 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -90.62 158.31 17.01 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.989 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . 0.404 ' O ' ' CG2' ' A' ' 106' ' ' VAL . 0.1 OUTLIER 66.89 -73.21 0.08 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.952 -179.999 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . 0.404 ' CG2' ' O ' ' A' ' 105' ' ' PHE . 21.5 m 45.13 -171.26 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.665 179.972 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -90.76 87.75 6.8 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.836 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -75.87 156.33 34.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.993 -179.882 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 26.0 t 67.68 -70.88 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.134 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 177.22 -44.36 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.803 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -175.78 175.39 2.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.852 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.167 -0.92 . . . . 0.0 110.893 -179.968 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 2.6 m . . . . . 0 N--CA 1.486 1.328 0 CA-C-O 120.773 0.321 . . . . 0.0 111.259 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' MET . . . . . 0.437 ' HA ' ' HG2' ' A' ' 36' ' ' PRO . 0.0 OUTLIER -58.05 170.93 0.59 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.054 -179.905 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -116.7 136.43 52.97 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.483 -179.497 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.413 ' CD1' ' CE ' ' A' ' 2' ' ' MET . 34.7 mt -126.27 125.39 67.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.408 179.386 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -134.35 161.2 35.65 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.869 0.366 . . . . 0.0 111.18 179.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 29.1 p -163.38 138.3 6.33 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.551 -179.45 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 20.3 mttt -101.74 31.48 3.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.931 -179.769 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -141.19 -47.48 0.39 Allowed 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.805 179.743 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 1.5 mpp? -120.37 -170.36 1.97 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.748 179.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -118.41 164.96 14.47 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.572 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.1 mm -89.95 115.1 28.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 121.073 0.463 . . . . 0.0 110.945 -179.576 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 20.1 p -100.35 155.81 35.97 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.924 179.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_exo -59.56 -17.51 42.03 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.39 2.06 . . . . 0.0 111.822 179.147 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.01 -40.47 22.06 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-O 121.108 0.48 . . . . 0.0 110.226 179.21 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 19.1 mt -73.42 -28.72 25.88 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.594 179.019 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.57 -45.01 48.12 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.169 178.819 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 42.9 tt0 -67.74 -37.32 82.01 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.371 178.809 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.438 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 57.6 t60 -59.29 -60.02 4.53 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 178.648 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 21.3 t -60.77 -45.36 97.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 110.142 -0.318 . . . . 0.0 110.142 178.396 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.672 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -57.65 -42.07 82.72 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.538 179.394 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.438 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 0.9 OUTLIER -59.67 -33.23 71.29 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 121.075 0.464 . . . . 0.0 110.043 179.607 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 19.8 mmm180 -74.15 -26.07 60.1 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.516 179.316 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.672 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 14.7 mt -66.44 -53.12 39.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.016 0.436 . . . . 0.0 109.942 178.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.77 -22.25 63.89 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.757 179.057 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 6.5 tptp -78.8 -28.08 44.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.15 179.191 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.418 HD23 ' CD1' ' A' ' 29' ' ' TRP . 33.5 mt -76.84 60.22 1.72 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.824 -179.844 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.16 -61.01 2.66 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.214 -179.785 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.418 ' HG2' ' NE1' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -90.03 39.72 0.97 Allowed 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.112 0.482 . . . . 0.0 110.672 179.675 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.418 ' CD1' HD23 ' A' ' 26' ' ' LEU . 23.4 m95 -147.87 -36.2 0.21 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.426 -178.776 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 14.3 tt0 -70.47 65.38 0.29 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.945 0.402 . . . . 0.0 110.278 179.478 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -78.26 -164.47 0.55 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.026 -179.471 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 94.7 m-70 -60.05 83.25 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.46 -179.599 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 37.3 mt -92.14 143.77 26.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.115 -0.493 . . . . 0.0 109.976 179.202 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.5 mp -138.51 114.95 10.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.858 0.837 . . . . 0.0 112.164 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.437 ' N ' ' CD ' ' A' ' 36' ' ' PRO . 22.2 m-80 72.02 49.0 0.26 Allowed Pre-proline 0 C--N 1.327 -0.393 0 CA-C-N 114.144 -1.389 . . . . 0.0 111.726 179.183 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.437 ' HG2' ' HA ' ' A' ' 2' ' ' MET . 19.4 Cg_endo -62.29 125.64 16.77 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.08 1.854 . . . . 0.0 112.052 -179.36 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -140.11 126.95 20.63 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.549 -0.46 . . . . 0.0 111.865 -179.814 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.402 ' N ' ' CD1' ' A' ' 38' ' ' ILE . 3.4 mp -119.34 138.35 50.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.418 179.323 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 22.1 mm -116.05 148.38 18.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.46 -179.485 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 11.0 mt -122.88 127.19 48.65 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.518 179.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 11.7 m -125.33 -171.16 2.31 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.789 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.456 ' CD ' ' CE2' ' A' ' 47' ' ' PHE . 5.2 ttpt -173.58 146.63 1.34 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.128 0.49 . . . . 0.0 110.765 -179.791 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -132.04 170.5 11.15 Favored Pre-proline 0 C--N 1.324 -0.506 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.299 179.228 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_exo -51.45 -19.7 7.43 Favored 'Trans proline' 0 N--CA 1.464 -0.241 0 C-N-CA 121.727 1.618 . . . . 0.0 112.302 -179.502 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.12 -77.95 0.29 Allowed 'General case' 0 N--CA 1.445 -0.724 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.104 179.344 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . 0.42 ' HA3' ' HA ' ' A' ' 67' ' ' GLU . . . -141.77 -155.68 6.55 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.859 -179.309 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.456 ' CE2' ' CD ' ' A' ' 42' ' ' LYS . 21.9 m-85 -108.94 151.13 26.72 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-O 121.639 0.733 . . . . 0.0 112.699 -179.232 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 75.7 t -124.98 141.45 45.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 114.482 -1.236 . . . . 0.0 110.517 -179.659 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -132.44 124.09 27.94 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.654 -0.248 . . . . 0.0 110.797 179.787 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 21.2 m-20 -119.04 149.19 42.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.602 -0.272 . . . . 0.0 110.547 179.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . 0.419 ' N ' HD12 ' A' ' 76' ' ' LEU . . . -146.69 140.42 25.92 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.829 0.347 . . . . 0.0 111.317 179.849 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.6 m -135.12 131.56 37.02 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.033 179.402 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 17.4 mt -133.33 136.4 54.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 121.013 0.435 . . . . 0.0 111.456 -179.547 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -103.6 131.28 50.88 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.148 178.963 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.519 ' HB ' ' HD2' ' A' ' 56' ' ' PRO . 5.8 p -127.83 163.33 43.98 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.444 -179.904 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.519 ' HD2' ' HB ' ' A' ' 55' ' ' THR . 53.6 Cg_endo -70.83 -5.67 17.41 Favored 'Trans proline' 0 C--N 1.343 0.25 0 C-N-CA 122.321 2.014 . . . . 0.0 112.687 179.921 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 67.7 m-80 -124.82 22.12 8.19 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.685 -0.234 . . . . 0.0 111.379 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 133.68 -167.76 23.46 Favored Glycine 0 C--N 1.33 0.212 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.784 179.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 14.1 t -137.24 144.7 31.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 120.665 0.269 . . . . 0.0 111.008 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.7 mp -119.34 152.4 36.82 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.108 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.435 ' O ' ' NE2' ' A' ' 83' ' ' GLN . 9.3 p -143.0 145.36 22.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.866 179.7 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -152.01 156.82 40.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.054 0.454 . . . . 0.0 111.814 -179.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 4.0 m -145.04 156.05 43.71 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.858 -179.155 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -150.15 105.38 0.29 Allowed Glycine 0 CA--C 1.519 0.324 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.445 179.355 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 2.1 mtpp -108.68 45.9 1.0 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.57 0.581 . . . . 0.0 112.57 -178.618 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.412 ' CE1' HG22 ' A' ' 71' ' ' THR . 12.8 t-80 -76.73 156.52 32.4 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.795 0.331 . . . . 0.0 110.28 178.547 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.42 ' HA ' ' HA3' ' A' ' 46' ' ' GLY . 2.0 pt-20 -61.89 -26.98 68.48 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.798 0.333 . . . . 0.0 111.3 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -97.68 123.12 41.47 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.106 0.479 . . . . 0.0 111.564 -179.313 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 26.0 ttt -48.35 -49.14 35.51 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.693 179.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 -66.32 -38.78 88.47 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.466 -179.211 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.412 HG22 ' CE1' ' A' ' 66' ' ' HIS . 84.7 m -64.53 -41.51 96.33 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.719 -179.889 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.78 -48.7 79.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.646 179.599 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 25.4 mt -60.34 -46.85 94.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 120.891 0.377 . . . . 0.0 110.564 179.647 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -64.16 -39.2 93.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.615 179.558 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -65.46 -47.4 76.27 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.363 179.533 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.419 HD12 ' N ' ' A' ' 51' ' ' ALA . 0.5 OUTLIER -50.75 -57.82 7.42 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 179.204 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 22.9 mm -56.04 -32.16 32.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 178.482 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -59.94 -27.83 67.12 Favored 'General case' 0 N--CA 1.442 -0.839 0 CA-C-O 121.099 0.476 . . . . 0.0 110.596 178.487 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.99 -26.87 23.57 Favored 'General case' 0 CA--C 1.521 -0.135 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.219 179.27 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 57.0 mt -62.87 -51.03 68.57 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 108.004 -1.109 . . . . 0.0 108.004 177.6 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -61.2 -44.83 96.65 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 114.567 -1.197 . . . . 0.0 110.778 177.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.51 -38.78 91.26 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.005 -179.356 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.435 ' NE2' ' O ' ' A' ' 61' ' ' VAL . 42.5 mt-30 -74.23 -39.15 63.27 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.874 0.369 . . . . 0.0 110.738 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.9 mt -64.96 -26.88 68.49 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.814 179.599 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 39.6 t30 -62.3 -38.15 88.28 Favored 'General case' 0 CA--C 1.523 -0.09 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.315 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 19.7 mttt -73.56 -25.33 60.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.975 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 27.5 mt -69.59 -15.58 63.24 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.271 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -76.38 -74.2 0.24 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.225 0.536 . . . . 0.0 110.927 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -83.75 161.22 21.07 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.982 179.974 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -169.76 165.21 9.95 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.93 179.864 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -128.32 -102.98 1.13 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.519 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 71.0 mt-10 -136.07 133.54 37.46 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.766 0.317 . . . . 0.0 110.939 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -113.92 109.9 19.24 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.081 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -108.39 128.52 54.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.935 179.968 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.48 89.72 3.16 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.938 179.938 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -124.28 71.8 1.15 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.116 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -106.73 120.55 42.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.167 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 82.6 p -71.47 -177.98 2.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.884 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 15.9 m -94.21 176.84 6.17 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.907 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 6.3 m -120.06 134.42 63.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.08 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 17.2 mtmt -80.46 107.76 13.53 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.044 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -155.3 174.01 15.82 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.836 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -151.18 106.3 3.32 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.132 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -149.21 33.57 0.73 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.786 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -128.89 137.79 51.64 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.887 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 15.3 m -148.7 73.31 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.068 179.886 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 67.96 -69.25 0.15 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.061 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 61.09 90.79 0.06 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.844 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 6.3 m -134.42 -45.89 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.212 -179.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 62.71 31.43 16.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.939 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.01 143.38 47.57 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.837 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 18.5 pt-20 . . . . . 0 C--O 1.25 1.108 0 CA-C-O 118.248 -0.882 . . . . 0.0 111.401 -179.999 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 9.4 t . . . . . 0 N--CA 1.487 1.4 0 CA-C-O 120.762 0.315 . . . . 0.0 111.254 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.12 135.98 39.83 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.921 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 31.5 t-20 -121.89 119.06 30.49 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.42 -179.52 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.443 HD13 HG23 ' A' ' 4' ' ' ILE . 36.4 mt -118.27 123.73 72.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.476 179.363 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -134.67 160.44 38.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.97 0.414 . . . . 0.0 111.281 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 21.6 p -163.92 142.42 7.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.584 -179.67 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 10.6 mttt -100.9 28.49 5.2 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.892 -179.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 3.5 tp-100 -141.25 -46.08 0.38 Allowed 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.622 179.692 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 5.4 mpp? -114.0 -176.81 2.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.683 179.764 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -120.52 169.74 10.05 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.518 179.819 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.714 ' CD1' ' N ' ' A' ' 11' ' ' ILE . 0.3 OUTLIER -88.44 101.69 12.01 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.012 0 CA-C-O 121.547 0.689 . . . . 0.0 110.623 -178.474 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 17.6 p -95.55 151.1 38.32 Favored Pre-proline 0 C--N 1.322 -0.606 0 CA-C-N 114.695 -1.139 . . . . 0.0 110.877 179.735 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -54.78 -26.64 48.52 Favored 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 122.438 2.092 . . . . 0.0 111.803 179.182 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -74.48 -44.48 51.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.578 179.406 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 21.3 mt -72.18 -27.78 27.66 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.326 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 178.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.5 -44.94 33.13 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.549 -0.751 . . . . 0.0 109.728 178.772 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 43.9 tt0 -67.67 -40.46 84.44 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.762 179.114 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.537 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 77.8 t60 -60.62 -58.02 10.23 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 179.167 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 25.2 t -60.7 -47.87 91.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.693 0.282 . . . . 0.0 110.32 178.704 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.697 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -59.04 -40.6 85.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.226 -0.443 . . . . 0.0 112.039 179.662 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.537 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 0.9 OUTLIER -59.7 -35.1 73.82 Favored 'General case' 0 C--N 1.332 -0.166 0 C-N-CA 120.512 -0.475 . . . . 0.0 109.887 179.737 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 5.6 mmm180 -76.53 -27.36 55.94 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.658 179.567 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.697 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 3.5 mt -68.54 -58.21 4.63 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.083 0.468 . . . . 0.0 110.529 179.687 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.65 -23.73 65.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.314 179.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 6.8 tmtt? -79.42 -29.79 42.05 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.132 0.491 . . . . 0.0 110.462 179.541 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.631 ' HB3' ' HB2' ' A' ' 29' ' ' TRP . 6.9 mt -79.34 58.29 2.55 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.077 -179.802 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.56 -73.49 0.08 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.216 -179.824 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.458 ' HD2' ' CE3' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -49.94 -27.78 5.8 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.216 0.531 . . . . 0.0 111.061 -179.791 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.631 ' HB2' ' HB3' ' A' ' 26' ' ' LEU . 34.1 m95 -87.83 45.12 1.24 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.357 179.828 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 27.7 mt-30 -157.43 70.51 0.6 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.112 179.749 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -77.59 -78.56 0.13 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.359 -179.086 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . 0.458 ' HB3' ' HD2' ' A' ' 56' ' ' PRO . 0.8 OUTLIER -133.24 65.11 1.6 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.565 -179.278 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.8 mt -89.99 146.05 24.65 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.066 179.237 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 29.3 mt -135.12 107.42 8.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 121.087 0.47 . . . . 0.0 112.036 -179.524 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 1.9 m120 51.67 74.36 0.81 Allowed Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 115.583 -0.735 . . . . 0.0 112.165 179.077 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -78.55 131.09 10.22 Favored 'Trans proline' 0 N--CA 1.463 -0.319 0 C-N-CA 122.557 2.172 . . . . 0.0 111.524 179.162 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 1.7 t-160 -107.43 129.79 54.89 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.07 0.462 . . . . 0.0 111.778 -179.261 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 3.4 mp -121.09 133.17 68.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.526 179.45 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 5.2 mt -118.89 149.2 21.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.228 -179.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 8.9 mt -124.93 126.86 46.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.89 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 34.6 m -123.49 -173.83 2.82 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.507 179.739 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.434 ' HG3' ' CD2' ' A' ' 47' ' ' PHE . 3.4 ttpt -160.48 139.05 10.22 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.306 0.574 . . . . 0.0 111.333 -179.644 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -130.76 156.56 79.71 Favored Pre-proline 0 C--N 1.323 -0.583 0 CA-C-N 115.129 -0.941 . . . . 0.0 109.281 179.146 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_exo -51.34 -24.55 16.11 Favored 'Trans proline' 0 C--O 1.232 0.187 0 C-N-CA 121.974 1.783 . . . . 0.0 112.481 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -89.07 -6.2 57.29 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.456 -0.793 . . . . 0.0 112.662 -179.242 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 149.16 -161.55 28.76 Favored Glycine 0 C--O 1.224 -0.48 0 C-N-CA 120.245 -0.979 . . . . 0.0 112.129 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.434 ' CD2' ' HG3' ' A' ' 42' ' ' LYS . 16.9 m-85 -110.36 154.59 23.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.523 0.678 . . . . 0.0 111.98 179.923 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 68.8 t -128.08 139.34 52.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 114.867 -1.06 . . . . 0.0 110.94 -179.266 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.422 ' O ' ' HA ' ' A' ' 63' ' ' SER . . . -131.27 124.51 30.65 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.761 179.715 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -118.96 147.98 43.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.743 0.306 . . . . 0.0 110.999 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . 0.445 ' N ' HD12 ' A' ' 76' ' ' LEU . . . -144.29 141.42 29.79 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.558 179.886 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.1 m -135.79 130.3 33.83 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.014 179.4 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 11.7 mt -130.54 134.19 62.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 120.825 0.345 . . . . 0.0 110.904 -179.54 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -104.24 133.49 49.07 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.68 179.623 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 6.3 p -134.29 135.25 23.7 Favored Pre-proline 0 C--N 1.326 -0.421 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.347 179.476 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.458 ' HD2' ' HB3' ' A' ' 32' ' ' HIS . 80.8 Cg_exo -45.87 -20.81 0.81 Allowed 'Trans proline' 0 CA--C 1.53 0.29 0 C-N-CA 122.381 2.054 . . . . 0.0 112.921 179.853 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -111.48 20.69 16.97 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 112.095 0.406 . . . . 0.0 112.095 -179.571 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 142.44 -174.71 23.25 Favored Glycine 0 C--N 1.332 0.342 0 C-N-CA 120.286 -0.959 . . . . 0.0 113.319 179.52 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 21.2 t -143.85 139.62 25.35 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-O 120.789 0.328 . . . . 0.0 111.005 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.5 mp -117.85 153.76 32.97 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.009 0.433 . . . . 0.0 111.612 -179.418 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 16.7 t -140.49 145.64 25.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.714 179.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -153.15 152.57 31.42 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.189 0.519 . . . . 0.0 111.841 -179.579 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' SER . . . . . 0.422 ' HA ' ' O ' ' A' ' 49' ' ' ALA . 0.1 OUTLIER -144.89 158.08 43.93 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.666 -179.437 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -151.55 105.28 0.28 Allowed Glycine 0 C--N 1.331 0.298 0 N-CA-C 111.497 -0.641 . . . . 0.0 111.497 179.341 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -106.71 44.83 1.02 Allowed 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.281 0.474 . . . . 0.0 112.281 -178.834 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 16.5 t-80 -75.4 156.36 35.45 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.635 -0.257 . . . . 0.0 110.317 178.601 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -59.61 -28.62 67.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.489 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 9.0 t0 -97.98 119.6 36.9 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.972 0.415 . . . . 0.0 111.566 -179.292 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 3.7 ttt -47.86 -47.01 31.84 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.516 179.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 35.5 m-85 -66.45 -42.28 87.82 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.151 -179.521 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 56.7 m -65.33 -37.4 86.98 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.669 179.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.4 -50.6 70.88 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.747 179.588 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 6.7 mt -61.97 -41.3 90.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 179.412 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -64.44 -41.45 96.56 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.062 179.091 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -66.31 -39.43 89.31 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.496 179.367 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.445 HD12 ' N ' ' A' ' 51' ' ' ALA . 0.4 OUTLIER -54.97 -63.73 1.06 Allowed 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 179.079 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 4.8 mt -54.64 -26.89 17.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 110.274 -0.269 . . . . 0.0 110.274 178.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.23 -40.22 85.21 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-O 121.48 0.657 . . . . 0.0 109.282 178.087 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 7.3 mmtm -73.94 -31.38 63.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 114.916 -1.038 . . . . 0.0 110.205 178.817 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 84.7 mt -62.88 -47.38 83.57 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 107.817 -1.179 . . . . 0.0 107.817 177.593 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.422 ' HG2' ' CE2' ' A' ' 29' ' ' TRP . 6.3 tt0 -60.73 -46.25 91.14 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 114.821 -1.082 . . . . 0.0 110.32 177.65 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.42 -31.24 72.34 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.741 -179.858 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 -74.81 -45.32 44.29 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.942 0.401 . . . . 0.0 110.436 179.684 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.4 mt -65.28 -26.17 67.96 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.865 179.681 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -62.71 -31.94 72.95 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.055 0.455 . . . . 0.0 110.357 179.647 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.32 -19.97 60.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.246 179.888 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 90.2 mt -69.26 -17.18 63.73 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.359 -179.808 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -76.27 -5.45 47.04 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.426 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.48 ' CD2' ' N ' ' A' ' 89' ' ' HIS . 1.3 p80 -154.84 137.8 15.47 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.926 0.393 . . . . 0.0 110.961 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 23.8 tptt -170.37 -68.49 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.966 179.605 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 107.35 28.01 5.06 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.484 -179.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -84.5 -177.81 6.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.807 0.337 . . . . 0.0 110.93 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -143.94 129.04 18.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.043 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 6.2 ttp180 -93.38 -33.85 13.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.911 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.25 115.38 18.24 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.929 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . 61.95 90.63 0.07 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.12 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -72.86 -24.13 60.83 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.202 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 2.6 m 70.66 -64.35 0.38 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.945 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -54.88 160.13 2.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.949 -179.972 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 28.3 m -126.44 155.19 36.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.245 -179.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 41.3 mttt -111.55 -33.37 6.39 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.905 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 61.87 77.38 0.33 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.865 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -175.51 -77.56 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.097 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 59.14 -172.45 0.11 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.871 179.869 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -151.63 169.45 22.1 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.838 -179.949 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 10.8 p -87.06 59.09 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.984 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -101.69 124.36 47.2 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.866 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -140.57 95.79 2.92 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.819 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 12.1 m -141.8 -47.18 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.138 179.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -124.88 145.19 49.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.902 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -176.16 78.07 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.922 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.199 -0.905 . . . . 0.0 110.899 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.487 1.401 0 CA-C-O 120.921 0.391 . . . . 0.0 111.209 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -62.35 132.93 54.24 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.694 179.942 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -124.45 130.52 52.62 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.297 -179.666 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 39.6 mt -136.2 124.82 37.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.667 179.621 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -134.45 160.74 37.04 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.941 0.401 . . . . 0.0 111.255 -179.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 21.9 p -162.67 145.75 11.09 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.39 -179.474 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.47 30.05 4.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.404 -179.47 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -142.39 -53.87 0.42 Allowed 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.806 179.579 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 2.1 mpp? -109.23 -176.68 3.09 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.803 179.8 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -115.72 168.74 9.76 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.666 179.754 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 5.1 mm -90.5 114.01 27.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 121.043 0.449 . . . . 0.0 111.143 -179.385 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 13.6 p -99.8 157.72 33.4 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.911 179.632 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -61.7 -15.76 44.21 Favored 'Trans proline' 0 C--N 1.343 0.265 0 C-N-CA 122.482 2.121 . . . . 0.0 111.88 179.056 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -83.15 -41.06 18.94 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-O 121.019 0.438 . . . . 0.0 110.263 179.181 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 42.2 mt -72.79 -29.09 28.73 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.285 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 178.801 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.43 ' O ' ' CB ' ' A' ' 20' ' ' ALA . 75.9 mtt180 -73.45 -47.33 42.35 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.521 178.667 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -67.15 -38.46 85.54 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.89 179.149 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.508 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 75.5 t60 -59.53 -62.7 1.68 Allowed 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.872 -0.418 . . . . 0.0 109.872 179.17 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.446 ' O ' ' HG ' ' A' ' 23' ' ' LEU . 22.6 t -60.82 -47.57 92.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.735 178.95 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.663 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -56.68 -44.84 81.85 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 111.855 0.317 . . . . 0.0 111.855 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.508 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 1.1 p30 -59.34 -32.97 70.58 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.044 0.449 . . . . 0.0 110.408 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 31.3 mmt180 -75.13 -28.85 60.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.859 179.793 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.663 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 3.5 mt -69.17 -54.43 14.91 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.96 0.41 . . . . 0.0 110.659 179.653 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.51 -25.93 62.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.103 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.3 -32.3 43.48 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.268 0.556 . . . . 0.0 109.875 178.965 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.595 ' HB3' ' HB2' ' A' ' 29' ' ' TRP . 31.6 mt -81.07 60.31 4.19 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.673 179.757 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -59.61 -76.3 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.536 -179.412 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.432 ' HG2' ' CD1' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -52.59 -21.84 4.33 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.084 0.468 . . . . 0.0 112.027 -179.6 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.595 ' HB2' ' HB3' ' A' ' 26' ' ' LEU . 50.2 m95 -85.5 -57.03 3.23 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.27 -178.623 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -91.97 33.42 1.06 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.767 0.317 . . . . 0.0 111.04 -179.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.404 ' CG2' ' N ' ' A' ' 32' ' ' HIS . 0.6 OUTLIER -81.93 -46.68 13.71 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.263 -179.646 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . 0.404 ' N ' ' CG2' ' A' ' 31' ' ' THR . 35.8 m170 -84.47 -26.9 27.86 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.545 -179.394 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 58.7 mt -50.27 146.65 4.93 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.029 -179.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 18.3 mt -133.13 105.43 8.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-O 120.759 0.314 . . . . 0.0 111.693 -179.67 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 51.7 78.78 0.38 Allowed Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.589 179.289 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -81.88 161.38 18.59 Favored 'Trans proline' 0 N--CA 1.462 -0.35 0 C-N-CA 122.779 2.319 . . . . 0.0 112.241 179.61 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 1.7 t-160 -136.68 128.77 29.59 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.918 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 3.7 mp -120.61 137.52 54.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.2 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 4.3 mp -114.7 148.28 17.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.877 179.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 10.0 mt -123.34 127.5 48.59 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.939 0.4 . . . . 0.0 111.018 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -125.06 -170.97 2.26 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.645 179.918 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.463 ' HG2' ' N ' ' A' ' 43' ' ' GLU . 2.7 ttmm -171.35 145.12 2.09 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.202 0.525 . . . . 0.0 111.039 -179.855 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.463 ' N ' ' HG2' ' A' ' 42' ' ' LYS . 2.2 mm-40 -130.1 166.28 27.64 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.015 178.816 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . 0.405 ' HD2' ' HB3' ' A' ' 43' ' ' GLU . 80.1 Cg_exo -48.72 -19.84 2.38 Favored 'Trans proline' 0 N--CA 1.463 -0.28 0 C-N-CA 121.837 1.691 . . . . 0.0 112.622 -178.946 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -85.38 -77.21 0.3 Allowed 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.004 179.078 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . 0.43 ' HA3' ' HA ' ' A' ' 67' ' ' GLU . . . -142.37 -153.69 5.97 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.629 -179.409 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.456 ' CE2' ' HG3' ' A' ' 42' ' ' LYS . 21.6 m-85 -109.29 150.5 27.88 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-O 121.709 0.766 . . . . 0.0 112.583 -179.354 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.412 ' HA ' ' HA ' ' A' ' 65' ' ' LYS . 59.8 t -124.37 140.39 47.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 114.397 -1.274 . . . . 0.0 110.254 179.955 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -131.62 124.98 31.07 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.66 0.267 . . . . 0.0 110.812 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -119.13 148.26 43.26 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.443 179.679 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -147.11 144.38 28.99 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.981 0.42 . . . . 0.0 112.063 179.84 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.0 m -136.75 129.29 30.26 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.704 179.163 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.415 HD13 HG21 ' A' ' 53' ' ' ILE . 9.0 mt -131.13 140.93 47.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-O 121.053 0.454 . . . . 0.0 111.716 -179.23 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -100.6 140.86 34.27 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.891 179.321 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 5.9 p -133.8 156.41 79.42 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.002 179.448 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_exo -65.24 -11.04 28.21 Favored 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 122.244 1.962 . . . . 0.0 112.659 -179.572 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 53.3 m-80 -125.92 21.4 7.55 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 111.75 0.278 . . . . 0.0 111.75 -179.605 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 143.95 -166.73 26.97 Favored Glycine 0 C--N 1.331 0.297 0 C-N-CA 120.258 -0.972 . . . . 0.0 113.181 179.627 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 16.6 t -140.13 143.63 29.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 120.68 0.276 . . . . 0.0 110.986 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.5 mp -118.01 152.16 36.05 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.919 0.39 . . . . 0.0 111.447 -179.676 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 19.6 t -140.8 147.31 22.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.881 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -153.91 156.73 38.06 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.235 0.54 . . . . 0.0 111.637 -179.724 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 26.5 p -144.4 158.22 43.86 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.738 -179.341 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -152.91 105.28 0.27 Allowed Glycine 0 C--N 1.334 0.418 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.731 179.638 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.412 ' HA ' ' HA ' ' A' ' 48' ' ' VAL . 3.0 mptt -107.1 44.93 1.02 Allowed 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -178.905 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.409 ' ND1' ' CG2' ' A' ' 71' ' ' THR . 12.6 t-80 -76.21 156.46 33.58 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.802 0.335 . . . . 0.0 110.233 178.596 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.43 ' HA ' ' HA3' ' A' ' 46' ' ' GLY . 5.0 mt-10 -61.38 -26.45 67.84 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.781 0.324 . . . . 0.0 111.132 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -98.32 122.13 41.12 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.034 0.445 . . . . 0.0 111.372 -179.48 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -47.93 -49.64 29.5 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.817 179.901 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 18.4 m-85 -65.96 -37.02 84.92 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.587 -179.158 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.409 ' CG2' ' ND1' ' A' ' 66' ' ' HIS . 97.9 m -64.59 -41.52 96.19 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.695 0.283 . . . . 0.0 110.559 -179.901 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.55 -47.66 84.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.522 179.514 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 14.1 mt -60.93 -46.34 96.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.584 179.553 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -64.44 -40.73 96.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.55 179.624 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -65.73 -44.53 85.72 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.604 179.795 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -53.23 -59.39 4.62 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.368 179.402 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 44.3 mt -56.12 -29.88 28.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 N-CA-C 110.183 -0.303 . . . . 0.0 110.183 179.023 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -58.72 -38.2 77.83 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.446 0.641 . . . . 0.0 109.668 178.45 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.77 -29.17 62.05 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.01 178.937 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 94.8 mt -62.06 -48.81 78.57 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 107.759 -1.2 . . . . 0.0 107.759 177.379 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.455 ' O ' ' CZ3' ' A' ' 29' ' ' TRP . 11.9 tt0 -62.68 -44.34 96.51 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 114.514 -1.221 . . . . 0.0 110.481 177.76 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.68 -32.13 73.15 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.028 -179.367 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -74.91 -41.75 59.11 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.123 0.487 . . . . 0.0 110.38 179.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.443 ' CB ' ' HE3' ' A' ' 29' ' ' TRP . 0.4 OUTLIER -65.11 -32.15 73.71 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.772 179.682 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . 0.442 ' O ' ' HG3' ' A' ' 88' ' ' GLN . 55.9 t30 -61.37 -33.6 73.91 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.549 -178.969 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.476 ' HA ' ' CE1' ' A' ' 89' ' ' HIS . 21.6 mttm -77.11 -27.45 54.05 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.335 -179.753 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 47.8 mt -72.29 -23.13 61.14 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 -178.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . 0.46 ' O ' ' N ' ' A' ' 90' ' ' LYS . 1.8 pt20 -78.24 -102.8 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 111.719 0.266 . . . . 0.0 111.719 -178.933 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.476 ' CE1' ' HA ' ' A' ' 86' ' ' LYS . 10.6 m-70 62.54 -72.69 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.007 0.432 . . . . 0.0 111.119 -179.226 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.46 ' N ' ' O ' ' A' ' 88' ' ' GLN . 40.4 mttm -69.91 -68.34 0.42 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.075 -179.266 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 143.76 -162.99 27.71 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.425 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -163.74 118.3 1.56 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.813 0.339 . . . . 0.0 110.9 179.942 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -98.29 38.09 1.37 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.156 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -92.77 109.36 20.79 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.929 -179.983 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.14 169.33 8.94 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.883 179.971 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -99.02 34.67 2.06 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.062 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -83.69 97.21 8.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.098 -179.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -148.37 160.83 42.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.949 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -139.43 100.74 4.06 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.873 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 10.0 p -160.19 158.63 2.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.132 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.419 ' HG2' ' N ' ' A' ' 102' ' ' ASP . 0.0 OUTLIER -173.77 -36.41 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.179 179.975 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . 0.419 ' N ' ' HG2' ' A' ' 101' ' ' LYS . 0.7 OUTLIER 61.35 77.2 0.34 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.877 0.37 . . . . 0.0 110.971 -179.978 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -120.63 82.18 1.87 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.084 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -111.45 44.99 1.25 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.93 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . 0.468 ' O ' ' CG1' ' A' ' 106' ' ' VAL . 52.2 t80 63.42 139.93 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.903 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . 0.468 ' CG1' ' O ' ' A' ' 105' ' ' PHE . 9.5 p 51.51 163.69 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.92 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 67.77 129.55 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.038 -179.793 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -160.13 -64.3 0.07 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.85 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 5.7 m -142.35 149.14 19.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.095 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 60.83 -172.22 0.14 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.889 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -130.43 -65.38 0.81 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.903 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.212 -0.899 . . . . 0.0 110.842 -179.955 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 6.2 t . . . . . 0 N--CA 1.487 1.417 0 CA-C-O 120.872 0.367 . . . . 0.0 111.209 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -145.12 169.38 18.27 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.858 -179.944 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -122.11 120.67 34.94 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.879 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 12.5 tt -125.58 124.42 66.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.731 179.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 3.0 p -134.51 163.73 29.05 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.832 0.348 . . . . 0.0 111.247 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 42.3 p -163.3 131.43 3.72 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.348 -179.5 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 11.7 mttt -100.7 42.39 1.12 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.914 -179.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -140.06 -46.14 0.43 Allowed 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.505 179.572 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 10.0 mtm -134.67 -178.87 5.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.468 179.664 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -89.93 164.35 14.6 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.673 179.863 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.0 mm -90.79 116.95 33.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.936 0.398 . . . . 0.0 110.859 -179.669 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 16.0 p -100.6 146.6 32.33 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.091 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_exo -55.33 -21.22 28.36 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.36 2.04 . . . . 0.0 111.652 179.12 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -74.72 -42.33 58.53 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 121.197 0.522 . . . . 0.0 110.287 179.331 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 38.8 mt -72.31 -30.42 35.21 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.305 178.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.438 ' O ' ' CB ' ' A' ' 20' ' ' ALA . 7.9 mtt180 -73.2 -46.41 50.6 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.602 178.666 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 47.5 tt0 -66.79 -37.0 83.7 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.641 179.106 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.49 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 50.2 t60 -59.88 -65.28 0.7 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.854 0.359 . . . . 0.0 110.067 179.014 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.401 ' O ' ' HG ' ' A' ' 23' ' ' LEU . 21.6 t -60.18 -46.5 94.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.97 179.168 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.636 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -57.26 -45.34 84.09 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 179.95 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.49 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 1.5 p30 -59.46 -31.56 69.43 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 120.809 -0.356 . . . . 0.0 110.64 -179.857 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 16.6 mmt180 -74.75 -28.6 60.83 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.81 179.726 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.636 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 1.6 mt -68.32 -51.61 42.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.935 0.398 . . . . 0.0 110.362 179.326 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.29 -24.13 63.02 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.823 179.592 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 7.0 tptp -77.43 -34.05 54.73 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.29 179.339 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.404 ' CD1' ' CG2' ' A' ' 77' ' ' ILE . 0.5 OUTLIER -81.33 55.31 2.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.715 179.37 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -116.01 -1.43 12.51 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.59 -179.714 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -70.92 -10.55 59.87 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.8 0.333 . . . . 0.0 111.359 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.526 ' CE3' HD22 ' A' ' 84' ' ' LEU . 62.1 m95 -84.67 -179.88 7.22 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.134 -179.908 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -114.58 -14.99 12.05 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.565 -179.82 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 15.1 t -76.57 111.43 12.04 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.151 0.501 . . . . 0.0 110.556 179.694 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 35.6 m-70 -60.28 169.23 1.7 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.32 -179.565 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.2 mp -143.22 130.15 20.55 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.174 -179.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.8 mp -121.89 103.15 13.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 121.439 0.638 . . . . 0.0 112.135 -179.167 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 50.43 78.62 0.39 Allowed Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 114.887 -1.052 . . . . 0.0 112.48 178.773 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 94.8 Cg_endo -83.38 133.31 6.25 Favored 'Trans proline' 0 N--CA 1.459 -0.532 0 C-N-CA 122.665 2.244 . . . . 0.0 111.132 178.673 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -105.07 127.36 52.85 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.065 0.46 . . . . 0.0 111.959 -179.01 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.4 ' CD1' ' N ' ' A' ' 38' ' ' ILE . 3.3 mp -120.16 134.09 64.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.062 179.168 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.485 HG23 HD11 ' A' ' 39' ' ' ILE . 39.1 mt -116.27 148.42 19.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.42 -179.635 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.2 mt -123.79 127.53 48.22 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.713 179.72 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -125.54 -170.52 2.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.712 -179.916 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.469 ' HA ' ' HA ' ' A' ' 47' ' ' PHE . 0.0 OUTLIER -171.56 145.43 2.04 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.243 0.544 . . . . 0.0 110.943 -179.833 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.469 ' HB3' ' HD2' ' A' ' 44' ' ' PRO . 2.8 mm-40 -130.38 164.9 38.01 Favored Pre-proline 0 C--N 1.323 -0.581 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.197 179.099 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . 0.469 ' HD2' ' HB3' ' A' ' 43' ' ' GLU . 3.2 Cg_endo -46.79 -21.82 1.64 Allowed 'Trans proline' 0 N--CA 1.462 -0.355 0 C-N-CA 122.239 1.959 . . . . 0.0 112.363 -179.282 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 45.5 tp60 -84.27 -78.6 0.23 Allowed 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.769 179.105 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . 0.406 ' HA3' ' HA ' ' A' ' 67' ' ' GLU . . . -141.07 -152.72 5.8 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.671 -179.288 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.469 ' HA ' ' HA ' ' A' ' 42' ' ' LYS . 19.6 m-85 -110.37 151.06 27.91 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.731 0.777 . . . . 0.0 112.819 -179.249 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 67.0 t -123.89 140.54 47.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 114.393 -1.276 . . . . 0.0 110.251 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.413 ' O ' ' HA ' ' A' ' 63' ' ' SER . . . -132.18 124.83 29.8 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.642 0.258 . . . . 0.0 111.003 -179.853 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -117.19 147.96 42.03 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.287 179.629 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . 0.422 ' N ' HD12 ' A' ' 76' ' ' LEU . . . -144.97 142.74 30.08 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.998 0.428 . . . . 0.0 111.852 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.0 m -135.02 130.18 35.27 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.848 179.324 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 16.1 mt -130.52 137.22 56.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.06 0.457 . . . . 0.0 111.464 -179.352 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -101.94 137.19 40.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.749 179.549 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 6.3 p -132.5 161.2 64.68 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.302 179.576 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_exo -68.12 -9.31 25.37 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.43 2.087 . . . . 0.0 112.582 -179.559 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -117.23 -3.71 11.46 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 111.744 0.275 . . . . 0.0 111.744 -179.773 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 158.33 -166.29 34.15 Favored Glycine 0 C--N 1.331 0.304 0 C-N-CA 120.366 -0.921 . . . . 0.0 112.754 179.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 21.2 t -134.02 140.87 45.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 120.845 0.355 . . . . 0.0 111.161 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 11.0 mt -115.54 156.91 24.88 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.027 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.412 ' O ' ' NE2' ' A' ' 83' ' ' GLN . 21.1 t -140.31 149.69 21.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.008 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -154.5 155.56 35.09 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.19 0.519 . . . . 0.0 111.544 -179.799 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' SER . . . . . 0.413 ' HA ' ' O ' ' A' ' 49' ' ' ALA . 0.5 OUTLIER -145.45 158.08 43.9 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.759 -179.277 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -151.88 109.19 0.41 Allowed Glycine 0 C--N 1.331 0.257 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.628 179.505 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -109.24 45.02 1.09 Allowed 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -178.861 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 13.0 t-80 -76.22 156.01 33.95 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.784 0.325 . . . . 0.0 110.367 178.651 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.406 ' HA ' ' HA3' ' A' ' 46' ' ' GLY . 0.3 OUTLIER -61.53 -27.52 68.67 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.723 0.297 . . . . 0.0 111.36 -179.84 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -98.2 121.47 40.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.012 0.434 . . . . 0.0 111.508 -179.39 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -47.95 -50.42 27.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.813 179.865 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 43.0 m-85 -66.85 -44.14 81.79 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.775 -179.016 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 16.8 m -63.96 -42.03 97.39 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.801 0.334 . . . . 0.0 110.883 -179.701 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.5 -47.99 83.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.715 179.611 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 16.4 mt -58.67 -44.28 89.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.96 0.41 . . . . 0.0 110.44 179.636 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -63.41 -36.11 82.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.362 179.373 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -64.85 -41.67 95.51 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.156 -0.475 . . . . 0.0 109.856 179.182 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.422 HD12 ' N ' ' A' ' 51' ' ' ALA . 0.2 OUTLIER -54.87 -59.9 4.1 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 178.878 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.404 ' CG2' ' CD1' ' A' ' 26' ' ' LEU . 6.9 mt -56.25 -30.48 30.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 110.013 -0.365 . . . . 0.0 110.013 178.727 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -59.85 -31.74 70.04 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-O 121.304 0.573 . . . . 0.0 110.157 178.196 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 7.2 mmtt -82.85 -24.87 33.06 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.485 179.162 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 93.4 mt -64.3 -47.63 78.71 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 107.574 -1.269 . . . . 0.0 107.574 177.111 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.492 ' O ' ' CD1' ' A' ' 84' ' ' LEU . 3.4 tt0 -59.31 -44.69 92.52 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 114.619 -1.173 . . . . 0.0 110.815 177.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -69.25 -37.08 77.76 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.706 -179.591 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.412 ' NE2' ' O ' ' A' ' 61' ' ' VAL . 36.6 mt-30 -78.19 -48.55 15.61 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 -178.665 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.528 ' CD1' ' N ' ' A' ' 85' ' ' ASN . 0.0 OUTLIER -63.7 -14.8 55.54 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 120.672 -0.411 . . . . 0.0 111.082 -179.402 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . 0.528 ' N ' ' CD1' ' A' ' 84' ' ' LEU . 0.2 OUTLIER -67.73 -28.23 67.47 Favored 'General case' 0 N--CA 1.457 -0.099 0 CA-C-O 121.152 0.501 . . . . 0.0 110.1 178.762 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.428 ' HA ' ' CD2' ' A' ' 89' ' ' HIS . 4.0 mmtm -71.04 -9.54 58.2 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.323 -179.757 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 14.7 mt -69.58 -26.45 64.48 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.861 0.362 . . . . 0.0 110.94 179.744 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -75.92 -10.09 59.14 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.329 -179.854 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.428 ' CD2' ' HA ' ' A' ' 86' ' ' LYS . 4.9 m170 -85.89 -60.76 1.92 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.983 0.421 . . . . 0.0 110.734 179.728 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 42.92 -166.8 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.613 -179.878 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -117.27 -17.46 5.73 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.806 -179.741 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 61.47 103.37 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.904 0.383 . . . . 0.0 110.944 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -161.12 120.62 2.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.081 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 2.8 ptt180 -146.75 83.66 1.59 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.97 -179.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -173.85 -171.98 0.7 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.874 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -86.6 -48.62 8.17 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.057 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -136.17 178.31 7.16 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.1 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 1.4 t -129.55 -52.95 1.17 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.956 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -165.91 -60.74 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.863 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 21.5 t -139.31 116.94 11.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.171 -179.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -161.99 179.33 8.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.928 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -171.63 142.2 1.56 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.876 179.935 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -102.63 132.56 48.65 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.167 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 28.9 m-20 -96.44 92.4 6.28 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.92 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 38.2 t80 -69.65 -48.11 61.01 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.916 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 21.5 t 63.82 139.19 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.111 179.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -100.59 -179.82 4.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.867 -179.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 66.39 -71.82 0.09 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.126 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 21.4 t 64.26 135.52 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.16 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -98.17 -176.67 3.49 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.823 179.973 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -117.14 -40.99 3.04 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.894 179.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.314 -0.85 . . . . 0.0 110.924 179.855 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 2.9 t . . . . . 0 N--CA 1.486 1.342 0 CA-C-O 120.857 0.361 . . . . 0.0 111.225 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.2 ptt? -59.3 149.04 29.95 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.867 179.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -121.95 128.55 51.63 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.107 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 36.9 mt -129.13 124.31 60.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.718 179.663 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -135.63 161.01 36.73 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.042 0.449 . . . . 0.0 111.397 -179.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 21.6 p -163.67 141.02 7.25 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.325 -179.682 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -100.36 27.74 5.5 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.183 -179.396 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -142.38 -45.34 0.33 Allowed 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.791 179.625 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 5.0 mpp? -113.23 -176.23 2.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.66 179.764 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -118.85 165.63 13.8 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.503 179.705 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 5.7 mm -89.73 109.3 20.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 121.149 0.499 . . . . 0.0 111.101 -179.413 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 16.1 p -98.19 159.09 31.54 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 115.428 -0.806 . . . . 0.0 110.986 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -62.54 -13.5 33.84 Favored 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 122.579 2.186 . . . . 0.0 111.919 179.006 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -86.59 -41.93 13.89 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.959 0.409 . . . . 0.0 110.597 179.483 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 25.5 mt -71.93 -31.52 40.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.844 -0.616 . . . . 0.0 109.587 179.44 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.401 ' CG ' ' N ' ' A' ' 17' ' ' GLN . 26.6 ptt180 -72.93 -44.24 61.43 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.485 178.796 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.401 ' N ' ' CG ' ' A' ' 16' ' ' ARG . 1.9 tm0? -65.62 -38.7 90.19 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.635 179.078 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.594 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 78.2 t60 -60.36 -50.05 75.16 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.48 -0.488 . . . . 0.0 109.685 178.787 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.694 ' O ' ' HG3' ' A' ' 22' ' ' ARG . 79.7 t -63.64 -44.01 98.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 177.982 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.632 ' HA ' ' HB2' ' A' ' 23' ' ' LEU . . . -63.24 -37.06 85.76 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.907 -0.317 . . . . 0.0 111.783 179.915 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.594 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 0.8 OUTLIER -60.3 -44.03 95.79 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 -179.611 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.694 ' HG3' ' O ' ' A' ' 19' ' ' VAL . 1.6 ppt_? -74.75 -16.63 60.72 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.728 0.775 . . . . 0.0 109.01 178.372 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.632 ' HB2' ' HA ' ' A' ' 20' ' ' ALA . 0.2 OUTLIER -70.2 -63.78 1.02 Allowed 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 114.387 -1.279 . . . . 0.0 109.918 178.858 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.01 -21.14 65.94 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.185 179.338 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.12 -29.81 38.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.993 0.425 . . . . 0.0 110.935 179.789 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.493 ' HB3' ' HB2' ' A' ' 29' ' ' TRP . 9.1 mt -79.19 60.52 3.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.028 -179.582 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.93 -69.52 0.29 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.601 -179.721 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.08 -23.79 3.4 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.281 0.562 . . . . 0.0 111.736 -179.683 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.493 ' HB2' ' HB3' ' A' ' 26' ' ' LEU . 73.1 m95 -85.14 -42.03 15.13 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.311 -0.859 . . . . 0.0 112.591 -178.754 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -68.35 69.62 0.15 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.964 0.411 . . . . 0.0 110.755 -179.924 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 9.5 t -78.42 -47.63 17.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.2 -179.759 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 69.0 m-70 -152.1 -89.6 0.06 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.357 -179.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 60.86 151.44 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.131 0 N-CA-C 110.199 -0.297 . . . . 0.0 110.199 -179.45 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.6 mp -140.01 109.72 3.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 121.109 0.48 . . . . 0.0 111.986 -179.749 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 54.49 73.18 0.93 Allowed Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 115.554 -0.748 . . . . 0.0 112.159 179.03 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -75.5 151.62 37.55 Favored 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 122.45 2.1 . . . . 0.0 111.433 178.871 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -134.26 133.25 40.6 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.202 0.525 . . . . 0.0 111.907 -179.14 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 13.9 mm -121.47 132.21 71.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.64 179.531 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 37.9 mt -119.69 146.74 23.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.98 -179.883 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 2.2 mt -124.35 126.36 45.87 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.013 0.435 . . . . 0.0 110.842 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -123.02 -173.17 2.65 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.421 179.615 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.419 ' HE3' ' CE2' ' A' ' 47' ' ' PHE . 81.9 tttt -163.55 139.28 6.6 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.386 0.612 . . . . 0.0 111.285 -179.764 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -130.85 158.79 73.95 Favored Pre-proline 0 C--N 1.323 -0.554 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.382 179.137 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_exo -52.05 -24.31 19.4 Favored 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 121.957 1.772 . . . . 0.0 112.489 179.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.26 -6.03 57.12 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.506 -0.77 . . . . 0.0 112.689 -179.107 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 148.86 -161.02 28.59 Favored Glycine 0 C--O 1.223 -0.542 0 C-N-CA 120.299 -0.953 . . . . 0.0 112.159 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.423 ' CD1' ' N ' ' A' ' 47' ' ' PHE . 18.0 m-85 -111.35 155.11 23.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.516 0.674 . . . . 0.0 111.989 -179.908 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 94.0 t -127.41 139.44 51.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 114.844 -1.071 . . . . 0.0 111.01 -179.24 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -130.65 122.41 27.33 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.447 179.4 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -119.61 147.04 44.98 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.808 0.337 . . . . 0.0 111.115 -179.616 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . 0.439 ' N ' HD12 ' A' ' 76' ' ' LEU . . . -143.56 139.43 29.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.207 179.719 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.0 m -135.95 130.54 33.84 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.294 179.674 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 23.4 mt -132.38 134.89 58.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 120.873 0.368 . . . . 0.0 111.215 -179.753 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 9.3 m120 -103.02 119.41 38.8 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.978 179.625 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 33.3 p -112.44 157.09 41.11 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.406 179.541 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -63.3 -14.25 40.89 Favored 'Trans proline' 0 C--N 1.342 0.227 0 C-N-CA 122.521 2.148 . . . . 0.0 112.643 -179.77 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 59.6 m-80 -117.77 24.17 11.23 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.463 -179.707 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 134.93 -167.58 23.98 Favored Glycine 0 C--N 1.331 0.262 0 C-N-CA 120.48 -0.867 . . . . 0.0 112.815 179.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 14.1 t -138.92 142.47 34.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 120.703 0.287 . . . . 0.0 110.956 -179.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 16.3 mt -116.5 151.21 36.56 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.033 -179.79 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 15.0 p -139.47 148.18 23.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.086 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -154.5 149.59 26.9 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.132 0.491 . . . . 0.0 111.559 -179.721 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 6.3 m -143.99 158.26 43.82 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.662 -179.437 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -150.48 105.34 0.29 Allowed Glycine 0 C--N 1.332 0.359 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.659 179.456 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -103.75 45.04 0.98 Allowed 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.14 0.422 . . . . 0.0 112.14 -178.904 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 12.5 t-80 -76.27 155.93 33.91 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.62 -0.264 . . . . 0.0 110.437 178.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -60.31 -28.0 67.77 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.587 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 7.2 t0 -98.29 120.13 38.17 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.957 0.408 . . . . 0.0 111.526 -179.308 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 24.2 ttt -48.05 -47.24 33.83 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.608 179.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -66.28 -41.21 90.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.101 -179.584 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 76.8 m -65.22 -37.22 86.6 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.416 -0.357 . . . . 0.0 110.613 179.779 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.08 -50.77 69.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.689 179.626 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 7.8 mt -62.08 -41.98 93.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 179.262 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -63.86 -39.86 95.2 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 178.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.443 ' HA ' ' HB3' ' A' ' 78' ' ' ASN . 5.3 mt-10 -66.88 -41.11 87.8 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.39 179.207 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.439 HD12 ' N ' ' A' ' 51' ' ' ALA . 0.2 OUTLIER -53.2 -61.65 2.16 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 178.838 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.4 ' CD1' ' HG2' ' A' ' 22' ' ' ARG . 52.2 mt -54.96 -30.27 23.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 178.502 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.443 ' HB3' ' HA ' ' A' ' 75' ' ' GLU . 0.0 OUTLIER -57.77 -38.48 75.51 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.065 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.14 -30.92 55.31 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 114.704 -1.135 . . . . 0.0 109.839 178.592 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 67.7 mt -64.74 -49.15 71.94 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 107.987 -1.116 . . . . 0.0 107.987 177.608 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -59.71 -48.73 80.52 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.151 177.633 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 50.5 mtt-85 -64.3 -25.57 68.11 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.962 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -74.63 -48.57 25.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.354 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.437 ' HB2' ' CE3' ' A' ' 29' ' ' TRP . 1.0 OUTLIER -64.5 -29.16 70.2 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.497 179.64 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 31.1 t-20 -61.54 -33.29 73.58 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.024 -0.535 . . . . 0.0 109.912 179.719 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.86 -26.49 61.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.362 179.423 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.19 -46.79 82.39 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.375 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 54.9 mt-30 -77.96 -13.19 59.97 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.864 179.302 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 81.0 m-70 62.57 -79.16 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.318 179.768 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 1.2 mmtt 61.46 155.17 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.718 -179.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 173.92 40.71 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.654 -0.784 . . . . 0.0 112.564 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -176.1 90.62 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.808 0.337 . . . . 0.0 110.94 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -59.33 112.98 1.94 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.132 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 22.9 mtp180 -67.71 -44.4 77.74 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.937 179.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -84.19 135.53 34.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.93 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -109.55 34.7 3.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.046 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -128.46 161.57 29.21 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.114 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 7.1 m -147.34 -57.47 0.25 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.933 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 20.5 m -123.8 125.72 45.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.966 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 12.3 p -104.31 56.87 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.075 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 59.92 27.06 16.37 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.995 179.988 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 56.85 103.16 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.031 179.986 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.416 ' HB3' ' CD1' ' A' ' 105' ' ' PHE . . . -69.89 -30.44 67.88 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.078 -179.97 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 61.86 103.0 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.938 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . 0.416 ' CD1' ' HB3' ' A' ' 103' ' ' ALA . 21.6 p90 -177.11 135.35 0.2 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.849 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 11.6 p -176.08 120.8 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.177 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 62.75 120.73 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.923 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 46.27 -169.29 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.247 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 21.5 t -107.23 149.25 10.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.05 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -104.3 -31.79 9.39 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.843 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -71.38 79.53 0.75 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.887 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.219 -0.896 . . . . 0.0 110.916 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' THR . . . . . 0.508 ' O ' ' O ' ' A' ' 2' ' ' MET . 48.0 p . . . . . 0 N--CA 1.486 1.336 0 CA-C-O 120.563 0.221 . . . . 0.0 111.292 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' MET . . . . . 0.508 ' O ' ' O ' ' A' ' 1' ' ' THR . 0.0 OUTLIER 51.03 126.88 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 121.444 0.64 . . . . 0.0 111.985 -179.911 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -120.02 97.58 5.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.276 -179.58 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 34.3 mt -97.04 124.89 50.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.645 179.455 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -134.44 159.9 39.64 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.953 0.406 . . . . 0.0 111.239 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 21.8 p -163.42 145.29 9.65 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.475 -179.766 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 20.8 mmtp -103.41 -6.04 22.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.576 -179.663 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -99.97 -28.21 13.19 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 120.747 0.308 . . . . 0.0 111.209 -179.848 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 37.9 mtm -140.14 -175.52 4.27 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.071 -179.874 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 -111.06 166.93 10.65 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.653 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 5.2 mm -89.97 108.98 20.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 121.101 0.477 . . . . 0.0 111.066 -179.567 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 17.1 p -97.53 154.66 37.88 Favored Pre-proline 0 C--N 1.326 -0.441 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.002 179.721 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_exo -59.54 -17.92 44.16 Favored 'Trans proline' 0 C--N 1.343 0.281 0 C-N-CA 122.466 2.111 . . . . 0.0 112.029 179.339 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.14 -43.48 17.72 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.883 0.373 . . . . 0.0 110.573 179.629 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 27.8 mt -72.6 -27.5 25.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.577 179.086 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 17.4 ttm180 -75.6 -44.77 41.32 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.367 178.732 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -67.84 -39.18 83.87 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.698 179.031 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.539 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 78.2 t60 -60.34 -57.23 13.67 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.843 -0.428 . . . . 0.0 109.843 178.989 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.403 ' O ' ' HG ' ' A' ' 23' ' ' LEU . 35.7 t -61.52 -47.68 92.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 120.778 0.323 . . . . 0.0 110.146 178.477 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.695 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -57.98 -42.34 84.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.958 179.755 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.539 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 0.9 OUTLIER -59.54 -35.21 73.77 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.118 0.485 . . . . 0.0 110.053 179.96 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 25.5 mmm180 -76.24 -26.64 56.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.541 179.415 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.695 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 4.1 mt -68.09 -56.48 8.69 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.01 0.434 . . . . 0.0 110.298 179.484 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.65 -23.58 64.89 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.366 179.736 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.2 tmtm? -78.31 -30.98 48.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.107 0.479 . . . . 0.0 110.344 179.459 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.584 ' HB3' ' HB2' ' A' ' 29' ' ' TRP . 4.8 mt -80.26 56.0 2.37 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.649 179.556 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -55.4 -44.42 76.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.402 -179.634 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.429 ' HG2' ' NE1' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -94.01 20.0 8.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.547 -179.717 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.584 ' HB2' ' HB3' ' A' ' 26' ' ' LEU . 9.4 m95 -146.94 20.13 1.26 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.679 0.276 . . . . 0.0 110.947 -179.67 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . 0.427 ' O ' ' N ' ' A' ' 32' ' ' HIS . 3.2 tp60 -125.29 -43.92 1.9 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.946 0.403 . . . . 0.0 110.19 179.467 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER 40.4 -89.06 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 115.535 -0.757 . . . . 0.0 112.027 179.646 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . 0.427 ' N ' ' O ' ' A' ' 30' ' ' GLN . 57.8 m-70 -127.14 -51.14 1.42 Allowed 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 111.873 0.323 . . . . 0.0 111.873 -179.468 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.426 ' HA ' ' CG2' ' A' ' 53' ' ' ILE . 21.2 mt 73.75 5.76 4.88 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 120.875 0.369 . . . . 0.0 111.123 -179.202 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.485 HG22 ' O ' ' A' ' 54' ' ' ASN . 6.1 tt 34.15 34.05 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.261 0 N-CA-C 113.196 0.813 . . . . 0.0 113.196 179.428 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.454 ' CB ' ' O ' ' A' ' 34' ' ' ILE . 4.4 m120 77.45 77.37 0.15 Allowed Pre-proline 0 C--N 1.321 -0.65 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 -176.976 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.407 ' HD3' ' HB2' ' A' ' 33' ' ' LEU . 90.7 Cg_endo -80.72 173.16 12.45 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 123.244 2.63 . . . . 0.0 113.394 -178.951 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -140.45 126.83 19.98 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.109 179.854 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.428 ' N ' ' CD1' ' A' ' 38' ' ' ILE . 3.0 mp -118.88 136.54 55.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.393 179.587 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 4.9 mt -121.06 148.64 24.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.566 -179.336 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.3 mt -124.24 126.8 46.71 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.624 -0.717 . . . . 0.0 110.643 179.583 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 2.8 m -123.93 -174.26 2.94 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.507 179.898 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.418 ' HG3' ' CD2' ' A' ' 47' ' ' PHE . 11.0 tttm -160.95 140.71 10.79 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.424 0.631 . . . . 0.0 111.396 -179.845 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.405 ' HB3' ' HD2' ' A' ' 44' ' ' PRO . 65.2 mt-10 -131.41 162.15 57.74 Favored Pre-proline 0 C--N 1.322 -0.596 0 CA-C-N 115.026 -0.988 . . . . 0.0 109.305 179.347 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . 0.405 ' HD2' ' HB3' ' A' ' 43' ' ' GLU . 13.4 Cg_endo -56.43 -25.7 59.12 Favored 'Trans proline' 0 N--CA 1.464 -0.229 0 C-N-CA 121.967 1.778 . . . . 0.0 111.95 179.621 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.09 -7.81 56.41 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.121 -0.945 . . . . 0.0 112.796 -179.059 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 150.52 -163.81 29.67 Favored Glycine 0 C--O 1.224 -0.522 0 C-N-CA 120.229 -0.986 . . . . 0.0 112.245 179.869 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.418 ' CD2' ' HG3' ' A' ' 42' ' ' LYS . 18.0 m-85 -108.87 154.85 21.54 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.499 0.666 . . . . 0.0 111.796 179.953 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 53.1 t -128.69 139.39 52.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 114.927 -1.033 . . . . 0.0 111.145 -179.27 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -130.42 123.91 30.89 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.525 179.441 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 28.7 m-20 -118.67 146.25 44.84 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.65 -0.25 . . . . 0.0 110.727 -179.845 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -145.66 140.64 27.45 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.724 -0.39 . . . . 0.0 111.484 179.8 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.0 m -134.59 128.96 34.23 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 179.102 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.426 ' CG2' ' HA ' ' A' ' 33' ' ' LEU . 21.4 mt -133.75 139.34 48.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 C-N-CA 120.724 -0.391 . . . . 0.0 111.852 -179.277 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.485 ' O ' HG22 ' A' ' 34' ' ' ILE . 0.9 OUTLIER -99.86 145.38 27.83 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.85 179.116 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 18.9 p -138.76 158.85 69.35 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.502 179.261 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -73.96 -1.41 10.82 Favored 'Trans proline' 0 N--CA 1.463 -0.31 0 C-N-CA 121.772 1.648 . . . . 0.0 112.729 -179.243 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -126.5 2.39 6.91 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.567 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 162.31 -164.8 35.74 Favored Glycine 0 C--N 1.333 0.363 0 C-N-CA 120.405 -0.902 . . . . 0.0 112.925 -179.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 21.3 t -132.8 148.16 31.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.802 0.334 . . . . 0.0 111.083 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 14.1 mt -121.09 136.01 55.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.428 -179.672 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 21.3 t -140.69 137.29 35.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.657 179.657 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -153.09 155.86 37.6 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.279 0.561 . . . . 0.0 111.892 -179.418 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 88.8 p -143.98 157.41 44.35 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.252 -0.885 . . . . 0.0 111.682 -179.31 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -150.92 99.64 0.2 Allowed Glycine 0 C--N 1.332 0.323 0 CA-C-N 115.833 -0.622 . . . . 0.0 111.559 179.461 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 59.9 mttt -100.83 44.57 1.01 Allowed 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -178.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 12.4 t-80 -75.66 155.31 35.89 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.256 178.709 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -60.46 -26.81 67.06 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.685 0.278 . . . . 0.0 111.29 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -97.09 116.7 29.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.99 0.424 . . . . 0.0 111.329 -179.449 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.7 tmt? -47.57 -46.42 28.01 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.665 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 -66.48 -41.41 89.01 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.31 -179.534 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 35.4 m -65.41 -37.67 87.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.787 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.88 -51.54 67.77 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.822 179.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 7.7 mt -61.64 -42.5 94.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 120.84 0.352 . . . . 0.0 110.319 179.561 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -63.67 -40.2 96.24 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.109 179.253 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -66.47 -42.58 87.32 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.635 179.413 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.55 -60.94 2.63 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 179.3 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 21.9 mt -56.66 -30.29 31.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 178.706 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -59.19 -29.06 67.2 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-O 121.272 0.558 . . . . 0.0 109.974 178.069 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.2 mptt -86.49 -29.32 22.84 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.384 179.184 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 84.1 mt -63.14 -49.76 73.09 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 177.671 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.432 ' HG3' ' CG ' ' A' ' 29' ' ' TRP . 4.1 tt0 -60.04 -46.44 89.51 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 114.926 -1.033 . . . . 0.0 110.416 177.759 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.51 -33.86 75.74 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.317 -179.506 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 37.0 mt-30 -74.73 -42.36 58.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.836 0.351 . . . . 0.0 110.451 179.765 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.404 ' CB ' ' HE3' ' A' ' 29' ' ' TRP . 1.5 mt -65.05 -29.26 70.14 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.61 179.523 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . 0.413 ' O ' ' HG3' ' A' ' 88' ' ' GLN . 2.4 t-20 -61.81 -49.26 77.05 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.133 0.492 . . . . 0.0 110.256 179.936 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.447 ' HA ' ' CD2' ' A' ' 89' ' ' HIS . 0.1 OUTLIER -76.69 -20.65 56.36 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.974 179.519 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 9.2 tt -71.31 -36.07 71.49 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -179.002 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . 0.413 ' HG3' ' O ' ' A' ' 85' ' ' ASN . 0.4 OUTLIER -76.43 -99.26 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 111.74 0.274 . . . . 0.0 111.74 -178.797 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.447 ' CD2' ' HA ' ' A' ' 86' ' ' LYS . 70.5 m-70 50.95 -91.34 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.788 0.328 . . . . 0.0 110.89 -179.381 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 68.66 -71.57 0.11 Allowed 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.06 179.661 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 140.79 -28.18 2.42 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.316 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -155.47 52.33 0.59 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.829 0.347 . . . . 0.0 110.772 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -80.78 65.3 5.87 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.158 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.31 27.22 0.3 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.909 179.846 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 177.29 90.81 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.66 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -122.9 -66.86 0.99 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.195 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . 60.06 163.21 0.05 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.016 -179.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -103.5 -58.66 1.84 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.897 179.976 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -158.48 113.44 2.58 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.779 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 27.7 m -66.86 108.51 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.152 -179.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 30.2 mttt -121.26 173.28 7.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.898 179.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -113.91 178.92 4.11 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.973 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -161.62 141.38 10.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.144 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 49.8 m-80 -146.01 142.13 28.34 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.831 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 60.42 31.2 20.29 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.827 179.975 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 17.1 m -136.97 98.6 1.67 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.14 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -76.38 154.77 34.63 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.859 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 19.6 pt-20 -68.18 125.93 27.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.894 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 12.3 p -109.55 145.1 16.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.117 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -84.6 100.26 11.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.852 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 62.31 149.96 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.912 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.243 -0.884 . . . . 0.0 110.914 179.965 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' MET . . . . . 0.698 ' HG3' HD11 ' A' ' 23' ' ' LEU . 8.2 ttp . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.736 0.303 . . . . 0.0 110.826 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -119.52 122.97 42.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.078 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.421 ' CG2' HD11 ' A' ' 40' ' ' LEU . 36.9 mt -120.68 125.54 74.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.849 179.76 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -134.02 160.71 36.92 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.862 0.363 . . . . 0.0 111.119 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.41 ' HB3' ' HB2' ' A' ' 40' ' ' LEU . 44.8 p -163.43 142.67 8.34 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.637 -179.533 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -102.47 31.25 4.15 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.002 -179.571 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -140.95 -48.0 0.41 Allowed 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.647 179.623 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -119.32 -174.29 2.69 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.638 179.72 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -114.33 167.63 10.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.618 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 5.0 mm -91.2 115.56 30.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.109 0.481 . . . . 0.0 111.085 -179.502 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.419 ' H ' HD12 ' A' ' 15' ' ' ILE . 15.4 p -99.74 149.33 35.83 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.887 179.75 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_exo -56.39 -19.64 29.47 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.335 2.023 . . . . 0.0 111.919 179.216 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -77.75 -41.6 37.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.078 0.466 . . . . 0.0 110.284 179.234 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.428 ' O ' HG23 ' A' ' 19' ' ' VAL . 22.9 mt -73.23 -29.1 27.22 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.367 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.517 178.951 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 13.3 ttp85 -74.12 -45.74 47.02 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.604 -0.726 . . . . 0.0 109.227 178.722 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 33.8 tt0 -67.46 -37.35 82.8 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.503 178.877 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.494 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 72.5 t60 -59.2 -62.49 1.85 Allowed 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 178.872 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.89 HG13 HD11 ' A' ' 77' ' ' ILE . 22.2 t -60.65 -46.56 95.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.609 -0.268 . . . . 0.0 110.536 178.849 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.678 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -57.06 -43.94 82.53 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.846 179.746 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.494 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 1.1 p30 -59.66 -33.34 71.42 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.95 0.405 . . . . 0.0 110.645 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 10.3 mmt180 -74.67 -28.16 60.72 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.058 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.698 HD11 ' HG3' ' A' ' 2' ' ' MET . 2.4 mt -67.53 -52.77 34.94 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.151 0.5 . . . . 0.0 110.293 179.453 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.48 -25.45 66.06 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.217 179.704 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.94 -28.28 43.72 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.934 179.958 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.66 HD12 ' HA ' ' A' ' 23' ' ' LEU . 5.8 mt . . . . . 0 C--N 1.328 -0.361 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.0 -179.816 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.825 ' HB3' HD12 ' A' ' 53' ' ' ILE . 77.0 Cg_endo . . . . . 0 N--CA 1.464 -0.233 0 CA-C-O 120.768 0.237 . . . . 0.0 111.958 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -136.84 130.05 31.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.233 -179.66 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.64 HD12 ' N ' ' A' ' 38' ' ' ILE . 3.4 mp -121.46 134.6 64.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.855 179.804 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 4.1 mp -116.95 146.04 21.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.999 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.507 HD21 HG12 ' A' ' 73' ' ' ILE . 1.8 mt -122.31 128.32 50.91 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.054 0.454 . . . . 0.0 111.023 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 5.3 m -123.99 -173.55 2.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.301 179.6 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.425 ' HG3' ' CD2' ' A' ' 47' ' ' PHE . 3.0 tttp -158.58 141.29 14.46 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.372 0.606 . . . . 0.0 111.43 -179.678 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -131.82 156.37 80.2 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-N 115.075 -0.966 . . . . 0.0 109.146 179.232 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_exo -51.73 -24.42 17.92 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 121.881 1.721 . . . . 0.0 112.382 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.72 -6.84 55.66 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.47 -0.786 . . . . 0.0 112.808 -179.148 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 149.68 -164.15 29.44 Favored Glycine 0 C--O 1.224 -0.501 0 C-N-CA 120.153 -1.022 . . . . 0.0 112.161 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.425 ' CD2' ' HG3' ' A' ' 42' ' ' LYS . 18.0 m-85 -108.19 152.63 24.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.544 0.688 . . . . 0.0 112.015 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.695 HG22 ' HG2' ' A' ' 65' ' ' LYS . 53.2 t -127.55 142.01 44.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 114.753 -1.112 . . . . 0.0 110.96 -179.23 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -132.45 124.88 29.45 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.986 179.666 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -117.7 149.5 40.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.436 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.64 ' N ' HD11 ' A' ' 76' ' ' LEU . . . -146.02 142.06 28.26 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.905 0.383 . . . . 0.0 111.798 -179.728 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.728 ' O ' HD13 ' A' ' 53' ' ' ILE . 4.4 m -134.35 134.04 41.33 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.278 179.651 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.825 HD12 ' HB3' ' A' ' 36' ' ' PRO . 3.4 mm -132.54 133.29 59.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.979 0.418 . . . . 0.0 111.16 -179.69 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 13.5 m-20 -102.98 130.86 50.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.427 179.02 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 7.3 p -128.6 165.74 29.38 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.749 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_exo -69.87 -8.98 24.96 Favored 'Trans proline' 0 CA--C 1.529 0.247 0 C-N-CA 122.703 2.269 . . . . 0.0 112.55 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 7.8 m120 -123.08 22.91 9.41 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 111.694 0.257 . . . . 0.0 111.694 -179.632 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 132.77 -167.42 23.23 Favored Glycine 0 C--N 1.331 0.255 0 C-N-CA 120.441 -0.885 . . . . 0.0 112.938 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.662 HG13 ' O ' ' A' ' 53' ' ' ILE . 14.9 t -136.43 143.48 35.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.813 0.339 . . . . 0.0 110.943 -179.853 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.9 mt -115.55 155.72 27.05 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.981 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 21.4 t -140.19 148.03 22.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.312 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.439 ' HB1' ' HB2' ' A' ' 79' ' ' LYS . . . -153.73 146.52 24.33 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.045 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -146.16 155.72 42.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.744 -179.442 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.462 ' O ' HG13 ' A' ' 48' ' ' VAL . . . -142.85 154.49 25.34 Favored Glycine 0 N--CA 1.452 -0.277 0 N-CA-C 111.181 -0.768 . . . . 0.0 111.181 179.128 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.695 ' HG2' HG22 ' A' ' 48' ' ' VAL . 19.6 mttt -147.59 42.92 1.08 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 117.239 0.519 . . . . 0.0 112.018 -179.336 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.629 ' ND1' HG21 ' A' ' 71' ' ' THR . 12.8 t-80 -76.06 154.96 35.25 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.303 178.935 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -60.96 -26.14 67.32 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.727 0.299 . . . . 0.0 111.165 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -98.5 121.94 41.07 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.044 0.45 . . . . 0.0 111.433 -179.343 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.9 ttt -48.33 -49.18 35.17 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.802 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 42.2 m-85 -65.75 -37.6 86.83 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.44 -179.242 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.629 HG21 ' ND1' ' A' ' 66' ' ' HIS . 93.6 m -64.85 -40.42 95.14 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.792 0.329 . . . . 0.0 110.613 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.82 -48.28 81.31 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.624 179.552 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.507 HG12 HD21 ' A' ' 40' ' ' LEU . 10.3 mt -60.52 -43.0 93.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.839 0.352 . . . . 0.0 110.181 179.384 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -65.21 -39.65 93.08 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.212 179.099 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -66.64 -45.61 78.46 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.728 179.707 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.64 HD11 ' N ' ' A' ' 51' ' ' ALA . 0.2 OUTLIER -53.42 -61.09 2.52 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.554 -0.294 . . . . 0.0 110.284 179.479 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.89 HD11 HG13 ' A' ' 19' ' ' VAL . 62.4 mt -55.37 -28.19 21.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 C-N-CA 120.899 -0.32 . . . . 0.0 110.201 179.086 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -58.99 -38.0 78.15 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 177.95 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.439 ' HB2' ' HB1' ' A' ' 62' ' ' ALA . 0.0 OUTLIER -73.25 -30.22 63.31 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 114.755 -1.112 . . . . 0.0 109.849 178.69 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 84.1 mt -63.31 -48.63 77.27 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 177.511 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -61.69 -49.44 76.46 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 114.625 -1.171 . . . . 0.0 110.52 177.801 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.07 -27.27 69.28 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.157 -179.77 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -75.38 -44.49 44.57 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.932 0.396 . . . . 0.0 110.686 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 3.5 mt -64.2 -26.46 68.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.71 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -63.6 -41.48 98.32 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.192 179.653 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 17.5 mmtt . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.285 179.907 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.7 tmt? . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.865 0.364 . . . . 0.0 110.906 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' ASN . . . . . 0.401 ' OD1' ' CE1' ' A' ' 37' ' ' HIS . 3.3 t-20 -127.76 109.38 11.59 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.278 -179.631 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.844 HG22 ' HB ' ' A' ' 38' ' ' ILE . 7.7 pt -118.19 128.66 75.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.702 179.561 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.551 ' HA ' HD11 ' A' ' 11' ' ' ILE . 2.9 p -134.0 165.85 24.07 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.229 -179.771 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.469 ' HB3' HD12 ' A' ' 40' ' ' LEU . 21.7 p -163.51 144.47 9.12 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.24 -179.787 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.77 -2.67 27.66 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.67 -179.54 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -98.85 -29.44 12.96 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 120.705 0.288 . . . . 0.0 111.041 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 34.6 mtm -143.41 178.79 7.51 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.032 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -98.74 163.88 12.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.69 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.632 HG22 ' HG3' ' A' ' 16' ' ' ARG . 5.0 mm -90.67 116.68 32.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.052 0.453 . . . . 0.0 111.05 -179.543 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 15.1 p -100.52 158.47 31.86 Favored Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.959 179.771 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_exo -63.32 -14.65 43.41 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.519 2.146 . . . . 0.0 111.911 179.091 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -84.49 -41.24 16.76 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-O 121.012 0.434 . . . . 0.0 110.434 179.507 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 34.6 mt -72.95 -30.5 32.44 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.299 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.284 178.749 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.674 ' HA ' HD11 ' A' ' 4' ' ' ILE . 47.3 mtp180 -71.67 -47.11 56.45 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.502 178.551 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 19.4 tt0 -67.18 -36.07 80.99 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.557 178.973 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.457 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 56.6 t60 -60.13 -64.56 0.91 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.951 0.405 . . . . 0.0 110.025 178.933 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.698 HG12 HD21 ' A' ' 23' ' ' LEU . 23.3 t -61.34 -47.1 95.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.9 179.128 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.66 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -56.44 -47.06 79.9 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 111.751 0.278 . . . . 0.0 111.751 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.457 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 3.2 p30 -59.83 -29.1 68.04 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.705 -0.398 . . . . 0.0 110.447 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 17.2 mmm180 -75.7 -29.85 59.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.591 179.41 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.698 HD21 HG12 ' A' ' 19' ' ' VAL . 1.3 mt -68.17 -50.62 53.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.942 0.401 . . . . 0.0 110.272 179.183 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.33 -24.32 63.25 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.803 179.467 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 29.4 tttt -78.1 -32.49 50.58 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.409 179.238 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.481 HD11 ' CG2' ' A' ' 77' ' ' ILE . 0.5 OUTLIER . . . . . 0 C--N 1.33 -0.25 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.757 179.542 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.5 ' HB3' HG23 ' A' ' 53' ' ' ILE . 86.3 Cg_endo . . . . . 0 N--CA 1.462 -0.328 0 N-CA-C 111.326 -0.298 . . . . 0.0 111.326 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' HIS . . . . . 0.401 ' CE1' ' OD1' ' A' ' 3' ' ' ASN . 1.6 t-160 -134.0 128.43 34.36 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.123 0.487 . . . . 0.0 111.612 -179.397 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.844 ' HB ' HG22 ' A' ' 4' ' ' ILE . 3.4 mp -120.73 135.63 60.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.594 179.491 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 26.5 mt -115.78 146.44 20.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.937 0.399 . . . . 0.0 111.254 -179.761 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.469 HD12 ' HB3' ' A' ' 6' ' ' SER . 2.9 mt -119.86 128.68 53.89 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.808 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 9.2 m -125.5 -170.46 2.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.733 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.487 ' HA ' ' HA ' ' A' ' 47' ' ' PHE . 3.6 ttpm? -173.29 145.96 1.35 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.186 0.517 . . . . 0.0 110.762 -179.812 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.443 ' HB3' ' HD2' ' A' ' 44' ' ' PRO . 5.5 mt-10 -131.0 170.47 11.15 Favored Pre-proline 0 C--N 1.324 -0.504 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.213 179.043 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' PRO . . . . . 0.443 ' HD2' ' HB3' ' A' ' 43' ' ' GLU . 69.0 Cg_exo -51.62 -19.34 7.31 Favored 'Trans proline' 0 N--CA 1.463 -0.282 0 C-N-CA 121.786 1.658 . . . . 0.0 112.354 -179.332 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.01 -78.71 0.27 Allowed 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.905 179.094 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' GLY . . . . . 0.404 ' HA3' ' HA ' ' A' ' 67' ' ' GLU . . . -141.16 -154.6 6.24 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.665 -179.281 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.487 ' HA ' ' HA ' ' A' ' 42' ' ' LYS . 20.1 m-85 -109.6 151.33 26.96 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 121.623 0.725 . . . . 0.0 112.726 -179.437 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.657 HG22 ' CG ' ' A' ' 65' ' ' LYS . 54.9 t -124.61 142.93 39.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 114.511 -1.222 . . . . 0.0 110.48 -179.888 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -132.9 126.08 31.33 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.238 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.419 ' O ' HG23 ' A' ' 38' ' ' ILE . 1.6 m-20 -118.92 150.28 40.17 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.583 179.713 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.645 ' HB2' HD21 ' A' ' 76' ' ' LEU . . . -146.8 141.14 26.37 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.845 0.355 . . . . 0.0 111.657 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.2 m -135.79 130.83 34.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.024 179.45 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.664 ' O ' HG13 ' A' ' 59' ' ' VAL . 13.4 mt -133.02 138.03 52.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 121.102 0.477 . . . . 0.0 111.785 -179.69 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 19.9 m-20 -102.05 119.25 38.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.723 179.362 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 10.6 p -112.23 156.3 42.24 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.453 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -63.48 -14.21 41.02 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 122.484 2.123 . . . . 0.0 112.619 -179.776 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 9.1 m120 -119.69 23.4 11.16 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.628 -0.26 . . . . 0.0 111.538 -179.644 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 137.07 -166.95 24.82 Favored Glycine 0 N--CA 1.453 -0.175 0 C-N-CA 120.488 -0.863 . . . . 0.0 112.902 179.791 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.664 HG13 ' O ' ' A' ' 53' ' ' ILE . 15.0 t -135.91 142.91 37.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.828 0.347 . . . . 0.0 111.037 -179.927 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 37.0 mt -116.98 152.75 33.94 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.11 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.522 ' H ' HE22 ' A' ' 83' ' ' GLN . 21.5 t -139.91 146.78 24.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.067 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -153.58 150.64 28.88 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.074 0.464 . . . . 0.0 111.205 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 94.3 p -145.69 156.17 43.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.73 -179.212 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.422 ' O ' ' HA ' ' A' ' 48' ' ' VAL . . . -144.39 146.91 17.83 Favored Glycine 0 C--N 1.331 0.302 0 N-CA-C 111.06 -0.816 . . . . 0.0 111.06 179.034 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.657 ' CG ' HG22 ' A' ' 48' ' ' VAL . 8.1 mttt -141.21 43.8 1.78 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 117.212 0.506 . . . . 0.0 112.056 -178.946 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.609 ' ND1' HG21 ' A' ' 71' ' ' THR . 12.9 t-80 -76.8 155.3 33.17 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.794 0.33 . . . . 0.0 110.436 178.887 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.404 ' HA ' ' HA3' ' A' ' 46' ' ' GLY . 21.2 mt-10 -61.13 -26.66 67.84 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.323 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -97.93 123.62 42.0 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.027 0.441 . . . . 0.0 111.45 -179.34 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.3 ttt -48.06 -50.15 29.0 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.774 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 72.6 m-85 -66.32 -38.29 87.35 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.672 -179.037 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.609 HG21 ' ND1' ' A' ' 66' ' ' HIS . 87.2 m -64.51 -42.57 95.73 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.698 0.285 . . . . 0.0 110.82 -179.775 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.09 -47.42 86.38 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.516 179.575 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.521 HG21 HG22 ' A' ' 19' ' ' VAL . 13.0 mt -60.13 -45.39 95.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 120.959 0.409 . . . . 0.0 110.311 179.459 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -64.62 -39.0 92.92 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.364 179.475 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -65.24 -43.59 90.9 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.412 179.46 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.645 HD21 ' HB2' ' A' ' 51' ' ' ALA . 0.2 OUTLIER -54.35 -57.34 11.64 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 179.065 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.577 HG13 HD23 ' A' ' 76' ' ' LEU . 8.7 mt -57.53 -30.58 36.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 N-CA-C 110.104 -0.332 . . . . 0.0 110.104 178.944 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -57.97 -37.78 74.82 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.561 0.696 . . . . 0.0 109.38 178.391 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -75.11 -28.9 60.41 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.708 -1.133 . . . . 0.0 109.935 178.873 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.483 HD12 ' HA ' ' A' ' 77' ' ' ILE . 99.3 mt -62.74 -49.45 74.98 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 177.424 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -62.29 -43.87 97.83 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 114.53 -1.214 . . . . 0.0 110.511 177.646 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 1.4 ptt180 -62.4 -34.61 77.07 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.638 -179.809 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' GLN . . . . . 0.522 HE22 ' H ' ' A' ' 61' ' ' VAL . 34.5 mt-30 -74.52 -39.22 62.51 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.478 179.57 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 19.3 mt -65.78 -26.01 67.51 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.846 179.581 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -63.93 -42.39 97.36 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.583 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.326 -0.426 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.051 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 2' ' ' MET . . . . . 0.729 ' HG3' HD11 ' A' ' 23' ' ' LEU . 1.9 tmm? . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.782 0.325 . . . . 0.0 110.862 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -121.01 111.13 17.09 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.142 -179.819 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 45.8 mt -110.68 125.6 67.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.848 179.65 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.8 p -134.04 160.58 37.31 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.123 179.786 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.431 ' HB3' ' HB2' ' A' ' 40' ' ' LEU . 39.3 p -163.5 140.54 7.25 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.462 -179.557 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.1 mttp -101.13 33.62 2.8 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.032 -179.615 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -140.62 -50.39 0.45 Allowed 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.53 179.584 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 7.7 mtm -120.6 -174.45 2.81 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.606 179.702 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -111.62 171.84 7.25 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.766 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.8 mm -90.93 112.6 25.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 121.063 0.459 . . . . 0.0 111.054 -179.644 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 15.9 p -98.69 153.05 38.09 Favored Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.886 179.608 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_exo -58.61 -17.1 33.38 Favored 'Trans proline' 0 C--N 1.345 0.342 0 C-N-CA 122.379 2.052 . . . . 0.0 111.879 179.139 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.34 -42.53 20.4 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-O 121.022 0.439 . . . . 0.0 110.44 179.399 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.474 ' O ' HG23 ' A' ' 19' ' ' VAL . 36.1 mt -72.81 -28.34 26.97 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 CA-C-N 115.747 -0.661 . . . . 0.0 109.376 178.946 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 1.8 mmm180 -75.2 -46.27 35.05 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.627 178.795 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 51.9 tp60 -67.72 -38.53 83.73 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.714 179.096 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.491 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 81.2 t60 -60.11 -61.43 2.61 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 179.049 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.61 HG12 HD21 ' A' ' 23' ' ' LEU . 29.7 t -60.75 -47.01 95.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 116.622 -0.263 . . . . 0.0 110.552 178.909 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.678 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -57.52 -42.64 83.21 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 111.753 0.279 . . . . 0.0 111.753 179.702 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.491 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 1.0 OUTLIER -59.96 -33.28 71.71 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 120.64 -0.424 . . . . 0.0 110.287 179.916 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 27.2 mmt180 -75.02 -28.03 60.32 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.056 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.729 HD11 ' HG3' ' A' ' 2' ' ' MET . 3.6 mt -68.85 -54.05 17.92 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.004 0.43 . . . . 0.0 110.408 179.397 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.62 -24.31 63.71 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.813 -0.631 . . . . 0.0 111.188 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -79.5 -30.88 42.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.112 0.482 . . . . 0.0 110.286 179.41 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 37.2 mt . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.793 179.987 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.593 ' HB3' HG23 ' A' ' 53' ' ' ILE . 89.6 Cg_endo . . . . . 0 N--CA 1.462 -0.375 0 N-CA-C 111.279 -0.316 . . . . 0.0 111.279 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' HIS . . . . . 0.487 ' O ' HD13 ' A' ' 38' ' ' ILE . 0.5 OUTLIER -109.7 132.46 54.12 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.119 0.485 . . . . 0.0 112.153 -178.904 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.701 HD12 ' CB ' ' A' ' 51' ' ' ALA . 10.8 mm -121.51 133.3 68.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.263 179.232 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.529 ' C ' HD22 ' A' ' 40' ' ' LEU . 3.8 mt -123.77 139.2 51.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 120.981 0.419 . . . . 0.0 111.5 -179.375 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.609 HD11 HG12 ' A' ' 73' ' ' ILE . 3.2 mm? -116.93 128.1 54.88 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.727 179.844 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.2 m -124.2 -175.2 3.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.6 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.436 ' HG3' ' CD2' ' A' ' 47' ' ' PHE . 13.5 tttm -158.4 140.15 13.73 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.365 0.602 . . . . 0.0 111.157 -179.558 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 60.1 mt-10 -131.5 156.11 80.56 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 115.105 -0.952 . . . . 0.0 109.313 179.19 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_exo -51.5 -24.67 17.3 Favored 'Trans proline' 0 N--CA 1.464 -0.24 0 C-N-CA 121.906 1.737 . . . . 0.0 112.435 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -89.61 -6.69 56.01 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.437 -0.801 . . . . 0.0 112.749 -179.122 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 150.36 -163.9 29.64 Favored Glycine 0 C--O 1.225 -0.443 0 C-N-CA 120.227 -0.987 . . . . 0.0 112.275 179.906 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.436 ' CD2' ' HG3' ' A' ' 42' ' ' LYS . 18.9 m-85 -109.07 154.43 22.26 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.559 0.695 . . . . 0.0 111.987 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.555 HG22 ' HG2' ' A' ' 65' ' ' LYS . 68.0 t -127.94 139.57 51.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 114.787 -1.097 . . . . 0.0 110.941 -179.391 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -131.14 124.06 29.89 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.597 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -120.08 147.03 45.36 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.658 0.266 . . . . 0.0 110.986 -179.865 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.701 ' CB ' HD12 ' A' ' 38' ' ' ILE . . . -144.35 140.92 29.39 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.829 0.347 . . . . 0.0 111.387 179.738 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.0 m -136.33 131.3 34.13 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.253 179.469 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.593 HG23 ' HB3' ' A' ' 36' ' ' PRO . 15.3 mt -132.45 135.59 57.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 120.865 0.364 . . . . 0.0 111.252 -179.604 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -104.11 121.16 42.65 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.648 179.372 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 7.6 p -116.29 155.03 48.83 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.622 179.791 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_exo -65.33 -11.92 32.44 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.515 2.143 . . . . 0.0 112.528 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 8.5 m-80 -112.37 -4.3 14.31 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 111.732 0.271 . . . . 0.0 111.732 -179.697 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 162.32 -166.98 36.72 Favored Glycine 0 C--N 1.331 0.27 0 C-N-CA 120.388 -0.91 . . . . 0.0 112.82 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 34.8 t -129.98 140.36 49.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 120.835 0.35 . . . . 0.0 111.134 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -118.34 142.58 47.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.818 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.435 ' O ' ' NE2' ' A' ' 83' ' ' GLN . 11.1 p -140.67 146.61 23.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.935 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.513 ' O ' HD12 ' A' ' 76' ' ' LEU . . . -155.85 152.68 28.66 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.265 0.555 . . . . 0.0 111.698 -179.798 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 67.1 m -143.23 160.46 40.43 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.709 -179.347 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.7 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -155.18 105.77 0.28 Allowed Glycine 0 CA--C 1.519 0.289 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.566 179.548 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.555 ' HG2' HG22 ' A' ' 48' ' ' VAL . 1.1 mtmp? -107.73 44.47 1.09 Allowed 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.1 0.408 . . . . 0.0 112.1 -178.812 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 14.6 t-80 -75.72 156.33 34.78 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.578 -0.283 . . . . 0.0 110.415 178.598 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -60.07 -27.28 66.84 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.673 0.273 . . . . 0.0 111.199 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -98.33 120.46 38.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.944 0.402 . . . . 0.0 111.475 -179.438 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' MET . . . . . 0.439 ' O ' HD12 ' A' ' 73' ' ' ILE . 13.3 ttt -48.2 -46.72 35.4 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.591 179.813 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 44.3 m-85 -66.47 -40.97 89.63 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.293 -179.418 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 86.8 m -65.26 -38.68 91.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.746 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.7 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -62.13 -50.71 70.8 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.8 179.607 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.609 HG12 HD11 ' A' ' 40' ' ' LEU . 7.0 mt -61.53 -43.78 97.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.788 0.327 . . . . 0.0 110.352 179.543 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -63.52 -40.25 96.55 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.246 179.339 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.12 -42.68 88.84 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.381 179.367 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.565 HD11 ' N ' ' A' ' 51' ' ' ALA . 0.2 OUTLIER -52.19 -62.0 1.91 Allowed 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 109.881 -0.415 . . . . 0.0 109.881 179.036 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 46.3 mt -55.05 -30.29 23.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 178.71 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -59.55 -29.58 68.02 Favored 'General case' 0 N--CA 1.442 -0.856 0 CA-C-O 121.22 0.533 . . . . 0.0 110.298 178.188 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.98 -28.34 22.73 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.354 179.155 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.786 ' O ' HD12 ' A' ' 84' ' ' LEU . 97.3 mt -63.7 -50.31 69.69 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 177.737 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -60.0 -50.67 72.83 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 114.907 -1.042 . . . . 0.0 111.057 177.934 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.52 -32.63 73.6 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.898 -179.349 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' GLN . . . . . 0.435 ' NE2' ' O ' ' A' ' 61' ' ' VAL . 41.4 mt-30 -74.2 -42.54 59.63 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.619 179.926 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.786 HD12 ' O ' ' A' ' 80' ' ' LEU . 1.6 mt -65.55 -29.2 69.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.462 179.464 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -63.25 -28.25 69.9 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.568 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 25.9 mmtt . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.249 -179.818 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' MET . . . . . 0.584 ' HG2' HD11 ' A' ' 23' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.459 0.023 0 CA-C-O 120.83 0.348 . . . . 0.0 110.978 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -122.38 112.98 18.75 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.392 -179.7 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.468 HG22 ' CD1' ' A' ' 11' ' ' ILE . 34.8 mt -109.97 126.75 67.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.539 179.419 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -134.38 162.25 32.75 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.862 0.363 . . . . 0.0 111.133 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 38.9 p -164.36 136.27 4.63 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.548 -179.739 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.6 mtpp -102.33 18.68 20.4 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.195 -179.737 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' GLN . . . . . 0.459 ' NE2' ' O ' ' A' ' 42' ' ' LYS . 28.2 mt-30 -141.72 20.61 2.17 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 120.881 0.372 . . . . 0.0 110.927 179.465 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 177.31 -177.99 0.18 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.545 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -117.84 160.22 21.77 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.855 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.468 ' CD1' HG22 ' A' ' 4' ' ' ILE . 3.4 mm -92.28 118.54 38.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.012 -179.746 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.492 ' H ' HD12 ' A' ' 15' ' ' ILE . 13.7 p -100.11 149.87 36.39 Favored Pre-proline 0 C--N 1.326 -0.424 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.701 179.528 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -56.23 -18.99 25.84 Favored 'Trans proline' 0 C--N 1.343 0.288 0 C-N-CA 122.4 2.067 . . . . 0.0 112.131 179.405 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.78 -39.93 25.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.069 0.461 . . . . 0.0 110.443 179.485 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.492 HD12 ' H ' ' A' ' 12' ' ' THR . 21.5 mt -72.93 -31.69 36.86 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.216 178.926 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.422 ' O ' ' CB ' ' A' ' 20' ' ' ALA . 0.2 OUTLIER -72.14 -47.37 51.49 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.537 178.854 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -66.94 -35.6 80.35 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.535 178.95 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.428 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 79.4 t60 -58.65 -65.27 0.69 Allowed 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 178.831 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.955 HG13 HD11 ' A' ' 77' ' ' ILE . 20.3 t -61.2 -46.17 97.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.819 178.992 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.616 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -55.37 -49.85 71.23 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 111.782 0.29 . . . . 0.0 111.782 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.428 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 3.2 p30 -58.58 -29.16 66.21 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.815 0.34 . . . . 0.0 110.709 -179.709 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.572 ' O ' HD12 ' A' ' 26' ' ' LEU . 41.9 mmt180 -75.14 -28.66 60.24 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.575 179.337 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.702 HD21 HG12 ' A' ' 19' ' ' VAL . 1.1 mt -69.41 -49.6 53.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.985 0.421 . . . . 0.0 110.529 179.148 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.35 -28.03 66.47 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.168 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.1 ttmm -79.53 -32.73 42.3 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.96 0.41 . . . . 0.0 110.587 179.356 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.572 HD12 ' O ' ' A' ' 22' ' ' ARG . 5.4 mt . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.782 179.814 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo . . . . . 0 C--O 1.231 0.174 0 CA-C-O 120.378 0.074 . . . . 0.0 111.947 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -139.44 127.7 22.65 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.934 0.397 . . . . 0.0 111.687 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.645 HD12 ' N ' ' A' ' 38' ' ' ILE . 3.3 mp -120.86 136.57 57.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.627 179.573 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 23.1 mt -116.91 146.13 21.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.075 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.3 mt -123.26 128.18 49.62 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.759 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 20.1 m -125.21 -172.45 2.59 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.388 179.77 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.459 ' O ' ' NE2' ' A' ' 8' ' ' GLN . 0.0 OUTLIER -162.55 145.28 11.05 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.367 0.603 . . . . 0.0 111.249 -179.878 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -133.57 169.89 12.78 Favored Pre-proline 0 C--N 1.322 -0.624 0 CA-C-N 115.052 -0.976 . . . . 0.0 109.322 179.339 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -61.71 -25.81 79.22 Favored 'Trans proline' 0 N--CA 1.464 -0.253 0 C-N-CA 121.91 1.74 . . . . 0.0 112.088 179.633 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -90.45 -8.39 50.65 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.273 -0.876 . . . . 0.0 113.044 -178.895 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 152.47 -169.06 31.62 Favored Glycine 0 C--O 1.225 -0.46 0 C-N-CA 120.065 -1.064 . . . . 0.0 112.515 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.448 ' CE2' ' HG3' ' A' ' 42' ' ' LYS . 10.7 m-85 -106.02 153.95 21.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.597 0.713 . . . . 0.0 112.162 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.597 HG22 ' HG2' ' A' ' 65' ' ' LYS . 54.3 t -127.58 141.39 46.5 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 CA-C-N 114.665 -1.152 . . . . 0.0 110.97 -179.322 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.444 ' O ' ' HA ' ' A' ' 63' ' ' SER . . . -133.05 123.2 25.34 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.549 179.642 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -119.56 150.77 39.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.648 0.261 . . . . 0.0 110.854 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.558 ' N ' HD11 ' A' ' 76' ' ' LEU . . . -147.44 139.73 24.51 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.75 0.309 . . . . 0.0 111.151 179.589 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 4.5 m -135.14 133.27 39.01 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.328 -0.397 . . . . 0.0 110.171 179.583 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.573 ' O ' HG13 ' A' ' 59' ' ' VAL . 18.5 mt -134.52 135.6 53.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.039 0.447 . . . . 0.0 111.387 -179.731 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -104.28 119.66 39.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.458 179.137 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 7.2 p -112.51 167.07 9.73 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.975 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_exo -71.37 -7.84 22.13 Favored 'Trans proline' 0 C--N 1.343 0.279 0 C-N-CA 122.899 2.4 . . . . 0.0 112.636 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -120.19 -4.41 10.0 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 111.776 0.287 . . . . 0.0 111.776 -179.589 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 160.61 -169.76 36.41 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.44 -0.886 . . . . 0.0 112.74 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.573 HG13 ' O ' ' A' ' 53' ' ' ILE . 15.9 t -130.07 143.3 41.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.781 0.324 . . . . 0.0 111.119 -179.944 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.4 mt -118.35 151.37 37.86 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.044 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.4 ' O ' ' NE2' ' A' ' 83' ' ' GLN . 21.4 t -140.57 143.55 28.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.887 179.882 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.445 ' O ' HD12 ' A' ' 76' ' ' LEU . . . -150.95 151.7 32.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.037 0.446 . . . . 0.0 111.603 -179.767 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' SER . . . . . 0.444 ' HA ' ' O ' ' A' ' 49' ' ' ALA . 2.0 t -145.09 155.74 43.51 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.722 -179.423 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.786 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -149.73 102.07 0.23 Allowed Glycine 0 C--N 1.331 0.279 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.609 179.413 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.597 ' HG2' HG22 ' A' ' 48' ' ' VAL . 5.5 mtmp? -103.84 44.55 1.01 Allowed 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -178.804 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.561 ' ND1' HG21 ' A' ' 71' ' ' THR . 12.2 t-80 -75.55 155.64 35.83 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 110.131 -0.322 . . . . 0.0 110.131 178.426 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -60.95 -26.73 67.74 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.731 0.3 . . . . 0.0 111.425 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -97.29 122.17 40.02 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.024 0.44 . . . . 0.0 111.426 -179.314 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 2.5 ttt -47.98 -51.01 25.47 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.891 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 15.9 m-85 -65.89 -37.6 86.55 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.567 -179.122 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.561 HG21 ' ND1' ' A' ' 66' ' ' HIS . 87.5 m -64.7 -41.16 96.21 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.791 0.329 . . . . 0.0 110.649 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.786 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -61.48 -48.2 82.21 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.439 179.607 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.418 ' CG2' HG22 ' A' ' 19' ' ' VAL . 15.7 mt -60.3 -45.47 96.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.869 0.366 . . . . 0.0 110.387 179.635 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -64.29 -39.6 94.25 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.5 179.449 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -65.28 -45.07 85.97 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.449 179.622 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.558 HD11 ' N ' ' A' ' 51' ' ' ALA . 0.3 OUTLIER -52.57 -58.2 7.53 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 179.129 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.955 HD11 HG13 ' A' ' 19' ' ' VAL . 34.7 mt -57.2 -32.45 40.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 178.82 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -59.0 -28.61 66.54 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-O 121.148 0.499 . . . . 0.0 110.174 178.434 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.17 -26.84 24.92 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.118 179.151 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.735 HD12 ' HA ' ' A' ' 77' ' ' ILE . 64.9 mt -62.86 -50.01 72.62 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 107.931 -1.137 . . . . 0.0 107.931 177.424 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -60.87 -44.67 96.75 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 114.598 -1.183 . . . . 0.0 110.571 177.711 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 1.1 ptt180 -62.85 -37.59 87.46 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.165 -179.557 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' GLN . . . . . 0.4 ' NE2' ' O ' ' A' ' 61' ' ' VAL . 35.3 mt-30 -74.28 -40.52 62.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.68 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.655 HD12 ' O ' ' A' ' 80' ' ' LEU . 3.3 mt -64.79 -24.25 67.49 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.682 179.657 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 17.8 t-20 -62.47 -27.73 69.33 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.42 179.592 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 8.0 mmtt . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.205 179.985 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.906 0.384 . . . . 0.0 110.841 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -120.78 98.8 6.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.15 -179.729 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.493 ' CG2' HD11 ' A' ' 40' ' ' LEU . 34.2 mt -102.63 124.16 56.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.643 179.586 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.8 p -134.25 159.58 40.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.987 0.422 . . . . 0.0 111.097 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 21.5 p -163.86 143.8 8.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.668 -179.758 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.6 mtmp? -102.51 35.89 2.32 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.035 -179.772 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -141.11 -47.63 0.4 Allowed 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.777 179.718 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 14.3 mtm -126.22 176.44 7.07 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.691 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -99.79 173.96 6.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.828 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 6.0 mm -91.77 110.76 23.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 121.097 0.475 . . . . 0.0 111.075 -179.677 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 13.2 p -97.52 149.5 35.78 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.146 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_exo -55.84 -20.59 29.51 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.423 2.082 . . . . 0.0 111.746 179.06 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -76.15 -43.92 40.67 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.046 0.45 . . . . 0.0 110.339 179.242 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.653 ' O ' HG23 ' A' ' 19' ' ' VAL . 32.2 mt -72.34 -27.85 27.37 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.283 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.58 179.118 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 29.4 ttt-85 -77.45 -43.68 31.6 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.714 -0.676 . . . . 0.0 109.531 178.809 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 34.3 tt0 -67.64 -40.69 84.58 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.638 179.067 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.529 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 79.5 t60 -60.99 -57.32 13.13 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.711 -0.395 . . . . 0.0 109.964 179.167 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.738 HG13 HD11 ' A' ' 77' ' ' ILE . 26.9 t -60.35 -47.81 90.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 178.675 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.707 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -59.72 -40.12 86.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.208 -0.451 . . . . 0.0 112.087 179.793 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.529 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 0.9 OUTLIER -59.59 -35.33 74.09 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 120.497 -0.481 . . . . 0.0 109.999 179.918 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.913 ' O ' HD12 ' A' ' 26' ' ' LEU . 0.5 OUTLIER -76.42 -27.21 56.18 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.775 179.557 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.707 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 5.3 mt -66.48 -56.03 12.82 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.046 0.45 . . . . 0.0 110.225 179.509 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.26 -21.62 64.08 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.162 179.555 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 6.0 tmtm? -79.24 -29.3 42.63 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.686 179.61 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.913 HD12 ' O ' ' A' ' 22' ' ' ARG . 0.4 OUTLIER . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.666 -179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo . . . . . 0 N--CA 1.466 -0.136 0 CA-C-O 120.686 0.203 . . . . 0.0 111.844 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -138.61 126.52 22.42 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.945 0.402 . . . . 0.0 111.521 -179.647 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.64 HD12 ' N ' ' A' ' 38' ' ' ILE . 3.4 mp -118.88 135.71 58.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.626 179.521 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 5.3 mt -116.73 147.08 20.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.227 -179.755 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.493 HD11 ' CG2' ' A' ' 4' ' ' ILE . 3.3 mt -121.9 127.23 50.21 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.696 179.785 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -124.1 -172.42 2.54 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.482 179.913 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.426 ' HG3' ' CD2' ' A' ' 47' ' ' PHE . 1.5 ttpt -161.52 139.52 9.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.299 0.571 . . . . 0.0 111.274 -179.686 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -130.81 157.54 77.55 Favored Pre-proline 0 C--N 1.323 -0.553 0 CA-C-N 115.189 -0.914 . . . . 0.0 109.306 179.159 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 70.9 Cg_exo -51.48 -24.63 17.1 Favored 'Trans proline' 0 N--CA 1.464 -0.215 0 C-N-CA 122.012 1.808 . . . . 0.0 112.464 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.5 tt0 -89.2 -6.08 57.18 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.479 -0.782 . . . . 0.0 112.659 -179.14 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 148.86 -160.91 28.56 Favored Glycine 0 C--O 1.224 -0.511 0 C-N-CA 120.289 -0.957 . . . . 0.0 112.224 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.456 ' CD1' ' N ' ' A' ' 47' ' ' PHE . 13.6 m-85 -110.17 154.74 22.91 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.574 0.702 . . . . 0.0 112.096 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.698 HG22 ' HG3' ' A' ' 65' ' ' LYS . 93.7 t -127.22 140.0 50.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 114.691 -1.141 . . . . 0.0 111.036 -179.012 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -131.49 122.19 25.76 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.41 179.402 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -120.3 149.32 42.49 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.691 0.281 . . . . 0.0 111.071 -179.639 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.579 ' N ' HD11 ' A' ' 76' ' ' LEU . . . -146.55 140.04 25.84 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.815 0.341 . . . . 0.0 111.32 179.535 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.0 m -134.33 131.86 38.83 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.031 179.484 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 21.9 mt -132.25 136.22 56.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 121.043 0.449 . . . . 0.0 111.676 -179.427 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 8.3 m120 -100.97 120.74 40.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.596 179.142 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.497 ' HB ' ' HD2' ' A' ' 56' ' ' PRO . 5.5 p -113.46 173.4 2.89 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.244 179.862 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' PRO . . . . . 0.497 ' HD2' ' HB ' ' A' ' 55' ' ' THR . 86.5 Cg_endo -86.98 1.67 7.29 Favored 'Trans proline' 0 N--CA 1.457 -0.642 0 C-N-CA 122.353 2.036 . . . . 0.0 112.632 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 5.0 m120 -131.58 20.95 4.68 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.315 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 139.99 -167.57 25.35 Favored Glycine 0 C--N 1.331 0.265 0 C-N-CA 120.603 -0.808 . . . . 0.0 112.646 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 19.0 t -128.68 144.12 39.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.757 0.313 . . . . 0.0 111.178 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 16.7 mt -118.33 144.4 45.89 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.026 -179.847 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 21.6 t -140.26 144.69 27.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.147 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.436 ' O ' HD12 ' A' ' 76' ' ' LEU . . . -153.37 149.77 28.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.063 0.459 . . . . 0.0 111.419 -179.805 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' SER . . . . . 0.417 ' HA ' HD12 ' A' ' 76' ' ' LEU . 56.0 p -145.08 159.93 42.19 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.866 -179.239 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.608 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -150.96 107.33 0.34 Allowed Glycine 0 C--N 1.333 0.371 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.713 179.408 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.698 ' HG3' HG22 ' A' ' 48' ' ' VAL . 0.7 OUTLIER -105.25 43.99 1.07 Allowed 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.062 0.393 . . . . 0.0 112.062 -178.813 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.445 ' CE1' HG21 ' A' ' 71' ' ' THR . 13.0 t-80 -77.45 155.51 31.71 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.713 0.292 . . . . 0.0 110.561 179.2 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -61.08 -26.91 67.98 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.337 179.88 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -98.68 118.99 36.65 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.983 0.42 . . . . 0.0 111.401 -179.313 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.8 tmt? -48.01 -45.77 32.21 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.547 179.829 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 34.4 m-85 -66.52 -41.05 89.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.222 -179.483 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.445 HG21 ' CE1' ' A' ' 66' ' ' HIS . 90.7 m -65.26 -38.28 89.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.877 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.608 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -62.25 -50.82 70.22 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.87 179.762 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.455 HD11 HD22 ' A' ' 40' ' ' LEU . 8.6 mt -62.01 -42.65 95.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.713 0.292 . . . . 0.0 110.275 179.511 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -63.91 -41.89 97.55 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.957 0.408 . . . . 0.0 110.1 179.206 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -65.93 -41.4 91.41 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.506 179.494 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.579 HD11 ' N ' ' A' ' 51' ' ' ALA . 0.3 OUTLIER -53.45 -62.92 1.34 Allowed 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 179.218 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.738 HD11 HG13 ' A' ' 19' ' ' VAL . 42.8 mt -54.74 -27.21 18.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 110.227 -0.286 . . . . 0.0 110.227 178.831 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.419 ' ND2' ' C ' ' A' ' 78' ' ' ASN . 0.0 OUTLIER -58.99 -39.98 83.46 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 178.0 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.424 ' HB2' ' HB1' ' A' ' 62' ' ' ALA . 0.0 OUTLIER -72.1 -30.62 65.27 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 114.844 -1.071 . . . . 0.0 109.944 178.613 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.846 ' O ' HD12 ' A' ' 84' ' ' LEU . 94.5 mt -63.66 -46.63 84.75 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 107.899 -1.148 . . . . 0.0 107.899 177.575 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 8.2 tt0 -59.98 -51.97 67.41 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 114.894 -1.048 . . . . 0.0 110.628 177.791 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.93 -25.43 68.14 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.384 -179.655 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -74.71 -47.6 30.52 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.837 0.351 . . . . 0.0 110.774 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.846 HD12 ' O ' ' A' ' 80' ' ' LEU . 1.1 mt -64.59 -25.37 67.94 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.809 179.742 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 -63.47 -33.29 75.25 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.923 0.392 . . . . 0.0 110.386 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.342 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.491 179.786 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 2' ' ' MET . . . . . 0.722 ' SD ' HD11 ' A' ' 23' ' ' LEU . 2.9 ttp . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.892 0.377 . . . . 0.0 110.89 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 43.9 t-20 -127.85 98.87 5.31 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.3 -179.819 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.913 HG22 ' HB ' ' A' ' 38' ' ' ILE . 18.3 pt -105.09 130.0 56.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.459 179.331 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 3.1 p -132.9 169.93 16.06 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.879 0.371 . . . . 0.0 111.052 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.443 ' HB3' ' HB2' ' A' ' 40' ' ' LEU . 25.0 p -162.84 136.71 6.14 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.314 -179.441 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -101.15 37.26 1.8 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.952 -179.781 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -140.82 -48.98 0.43 Allowed 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.592 179.625 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -123.11 174.27 7.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.55 179.78 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.5 pm0 -93.95 165.17 12.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.518 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.5 mm -90.98 114.33 28.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 121.012 0.434 . . . . 0.0 110.983 -179.514 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 11.2 p -99.57 150.0 36.39 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.004 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -56.98 -19.24 31.47 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.318 2.012 . . . . 0.0 111.755 178.88 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -76.8 -42.77 39.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.092 0.473 . . . . 0.0 110.257 179.27 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.562 ' O ' HG23 ' A' ' 19' ' ' VAL . 31.9 mt -72.62 -28.59 28.16 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 CA-C-N 115.575 -0.739 . . . . 0.0 109.446 178.908 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.41 ' O ' ' CB ' ' A' ' 20' ' ' ALA . 53.2 mtp180 -74.82 -45.84 40.7 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.609 178.696 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -67.35 -38.52 84.95 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.616 179.158 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.448 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 77.8 t60 -60.25 -61.74 2.38 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 179.075 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.796 HG13 HD11 ' A' ' 77' ' ' ILE . 18.9 t -60.56 -47.18 93.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 116.618 -0.264 . . . . 0.0 110.676 178.933 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.689 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -58.14 -44.91 88.1 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.354 0.501 . . . . 0.0 112.354 -179.962 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.448 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 0.9 OUTLIER -59.83 -32.84 71.03 Favored 'General case' 0 C--N 1.333 -0.146 0 C-N-CA 120.364 -0.534 . . . . 0.0 110.219 -179.542 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.547 ' O ' HD12 ' A' ' 26' ' ' LEU . 0.0 OUTLIER -73.1 -28.44 62.28 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.652 179.181 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.722 HD11 ' SD ' ' A' ' 2' ' ' MET . 5.1 mt -68.44 -53.86 20.8 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.954 0.406 . . . . 0.0 110.599 179.536 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.34 -23.81 62.82 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.233 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -79.22 -33.36 43.77 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 121.206 0.527 . . . . 0.0 110.113 179.346 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.547 HD12 ' O ' ' A' ' 22' ' ' ARG . 6.1 mt . . . . . 0 C--N 1.327 -0.371 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.047 -179.718 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.551 ' HB3' HG23 ' A' ' 53' ' ' ILE . 92.9 Cg_endo . . . . . 0 N--CA 1.462 -0.354 0 CA-C-O 120.703 0.21 . . . . 0.0 112.0 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -138.34 127.95 24.94 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.976 0.417 . . . . 0.0 111.411 -179.617 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.913 ' HB ' HG22 ' A' ' 4' ' ' ILE . 4.9 mp -120.32 137.2 54.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.929 179.708 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 28.1 mt -119.54 142.21 35.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.172 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.89 HD21 ' CG1' ' A' ' 73' ' ' ILE . 10.0 mt -120.36 130.15 54.27 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.97 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 14.9 m -125.22 -170.65 2.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.528 179.786 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.427 ' HG3' ' CD2' ' A' ' 47' ' ' PHE . 3.5 ttpt -158.67 141.41 14.44 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.431 0.634 . . . . 0.0 111.359 -179.7 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -131.32 156.86 79.56 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 115.113 -0.949 . . . . 0.0 109.217 179.143 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_exo -51.82 -24.46 18.54 Favored 'Trans proline' 0 C--O 1.232 0.198 0 C-N-CA 121.942 1.761 . . . . 0.0 112.375 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 34.5 tt0 -89.44 -6.71 56.28 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.501 -0.772 . . . . 0.0 112.778 -179.146 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 149.22 -162.56 29.02 Favored Glycine 0 C--O 1.225 -0.422 0 C-N-CA 120.269 -0.967 . . . . 0.0 112.205 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.427 ' CD2' ' HG3' ' A' ' 42' ' ' LYS . 18.5 m-85 -109.06 152.65 24.74 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.548 0.689 . . . . 0.0 112.026 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.648 HG22 ' CG ' ' A' ' 65' ' ' LYS . 63.8 t -126.51 141.01 47.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 114.829 -1.078 . . . . 0.0 110.912 -179.324 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -132.13 123.78 27.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.753 179.645 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.403 ' O ' HG23 ' A' ' 38' ' ' ILE . 2.7 m-20 -119.52 149.84 41.24 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.603 0.24 . . . . 0.0 110.855 -179.81 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.53 ' N ' HD11 ' A' ' 76' ' ' LEU . . . -147.3 139.89 24.78 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.72 0.295 . . . . 0.0 111.419 179.615 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.0 m -135.78 129.88 33.19 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.924 -0.399 . . . . 0.0 109.924 179.226 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.566 ' O ' HG13 ' A' ' 59' ' ' VAL . 8.3 mt -133.03 140.42 47.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-O 121.177 0.513 . . . . 0.0 111.96 -179.326 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 8.6 m120 -100.89 118.72 37.49 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.496 -0.774 . . . . 0.0 110.775 179.212 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.4 ' HA ' ' HD3' ' A' ' 56' ' ' PRO . 5.9 p -111.05 146.27 34.16 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.153 179.327 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 55' ' ' THR . 32.3 Cg_exo -58.01 -17.52 31.51 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.27 1.98 . . . . 0.0 112.573 -179.451 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -118.67 23.68 11.33 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.581 -0.282 . . . . 0.0 111.572 -179.714 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 143.99 -165.2 27.38 Favored Glycine 0 C--N 1.331 0.263 0 C-N-CA 120.427 -0.892 . . . . 0.0 113.073 179.77 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.566 HG13 ' O ' ' A' ' 53' ' ' ILE . 18.4 t -139.84 142.77 31.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.802 0.334 . . . . 0.0 111.015 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.9 mt -118.64 146.39 44.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.947 0.403 . . . . 0.0 111.299 -179.659 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 21.6 t -139.37 145.3 27.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.807 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -154.03 151.64 29.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.2 0.524 . . . . 0.0 111.648 -179.682 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' SER . . . . . 0.441 ' HA ' HD12 ' A' ' 76' ' ' LEU . 0.8 OUTLIER -143.13 156.71 44.85 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.416 -0.811 . . . . 0.0 111.575 -179.393 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.599 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -151.43 105.86 0.29 Allowed Glycine 0 C--N 1.331 0.305 0 N-CA-C 111.487 -0.645 . . . . 0.0 111.487 179.443 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.648 ' CG ' HG22 ' A' ' 48' ' ' VAL . 0.1 OUTLIER -107.92 45.06 1.03 Allowed 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 -178.806 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 15.2 t-80 -75.74 156.15 34.89 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.732 0.301 . . . . 0.0 110.353 178.552 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -60.61 -27.48 67.78 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.323 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -97.89 120.73 38.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.031 0.443 . . . . 0.0 111.461 -179.307 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -48.15 -48.21 34.41 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.724 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 8.2 m-85 -66.4 -41.16 89.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.332 -179.338 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 60.1 m -64.99 -39.49 93.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.798 0.333 . . . . 0.0 110.699 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.599 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -61.72 -50.42 72.49 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.672 179.642 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.89 ' CG1' HD21 ' A' ' 40' ' ' LEU . 8.5 mt -60.87 -43.56 95.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.88 0.372 . . . . 0.0 110.324 179.515 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -63.93 -38.87 92.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.091 179.272 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -66.17 -44.77 83.08 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.409 179.343 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.53 HD11 ' N ' ' A' ' 51' ' ' ALA . 0.3 OUTLIER -51.4 -58.97 4.8 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 179.038 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.796 HD11 HG13 ' A' ' 19' ' ' VAL . 43.5 mt -57.36 -29.32 32.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 109.916 -0.402 . . . . 0.0 109.916 178.6 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -58.84 -30.54 67.75 Favored 'General case' 0 N--CA 1.442 -0.859 0 CA-C-O 121.192 0.52 . . . . 0.0 109.932 178.079 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.5 mptt -84.0 -27.93 28.07 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.387 -0.824 . . . . 0.0 109.834 178.612 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.717 ' O ' HD12 ' A' ' 84' ' ' LEU . 89.8 mt -63.74 -49.55 72.6 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 177.493 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -60.26 -50.18 74.67 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 114.862 -1.063 . . . . 0.0 110.501 177.616 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.88 -25.14 68.15 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.098 -179.741 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 8.4 mt-30 -75.33 -45.68 37.97 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.926 0.393 . . . . 0.0 110.42 179.759 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.717 HD12 ' O ' ' A' ' 80' ' ' LEU . 1.1 mt -65.81 -30.98 71.69 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.83 179.832 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 47.1 t30 -61.82 -27.75 68.99 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.698 -179.689 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 2.9 mmtt . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.142 -179.928 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' MET . . . . . 0.47 ' HE1' ' HA ' ' A' ' 16' ' ' ARG . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.814 0.34 . . . . 0.0 110.95 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -124.87 130.56 52.61 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.196 -179.795 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.432 HD11 ' SD ' ' A' ' 2' ' ' MET . 38.7 mt -132.7 126.84 55.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.833 179.867 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -133.63 162.2 32.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.988 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.424 ' HB3' ' HB2' ' A' ' 40' ' ' LEU . 21.5 p -164.08 136.92 5.1 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.631 -179.581 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.94 39.26 1.49 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.797 -179.891 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -140.6 -47.81 0.42 Allowed 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.687 179.824 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -133.64 -178.36 4.97 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.898 179.792 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -93.23 164.03 13.39 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.671 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 3.7 mm -90.31 121.05 40.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.886 0.374 . . . . 0.0 110.695 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 17.7 p -101.81 148.21 34.97 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.086 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -56.77 -19.75 32.35 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.413 2.076 . . . . 0.0 111.773 179.203 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -77.61 -40.66 41.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.223 0.535 . . . . 0.0 110.374 179.618 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 26.4 mt -73.09 -31.27 34.4 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.327 178.958 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.47 ' HA ' ' HE1' ' A' ' 2' ' ' MET . 6.8 mtt85 -72.64 -46.45 53.99 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.512 178.616 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -67.09 -34.81 78.44 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.332 178.828 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.431 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 78.7 t60 -59.4 -66.02 0.58 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.039 0.447 . . . . 0.0 109.968 178.909 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.683 HG12 HD21 ' A' ' 23' ' ' LEU . 15.7 t -61.41 -46.04 97.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.887 179.166 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.639 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -55.56 -48.25 75.07 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 111.601 0.222 . . . . 0.0 111.601 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.431 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 2.7 p30 -59.51 -28.82 67.39 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.885 0.374 . . . . 0.0 110.538 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.616 ' O ' HD12 ' A' ' 26' ' ' LEU . 18.2 mmt180 -74.75 -29.2 61.07 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.517 179.451 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.683 HD21 HG12 ' A' ' 19' ' ' VAL . 1.1 mt -69.44 -49.65 53.06 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.594 179.185 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.87 -24.96 62.85 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.915 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.45 -37.41 43.65 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.569 179.315 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.616 HD12 ' O ' ' A' ' 22' ' ' ARG . 2.6 mt . . . . . 0 C--N 1.328 -0.334 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.81 179.625 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_endo . . . . . 0 N--CA 1.466 -0.126 0 N-CA-C 111.745 -0.137 . . . . 0.0 111.745 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 37' ' ' HIS . . . . . 0.443 ' O ' HD13 ' A' ' 38' ' ' ILE . 2.0 t-160 -134.01 132.63 40.33 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.03 0.443 . . . . 0.0 111.521 -179.711 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.443 HD13 ' O ' ' A' ' 37' ' ' HIS . 24.5 mm -123.19 133.7 68.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.773 179.726 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 37.0 mt -120.63 142.21 37.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.875 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.564 HD21 ' CG1' ' A' ' 73' ' ' ILE . 6.1 mt -121.48 127.41 51.04 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.988 0.423 . . . . 0.0 110.813 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -124.47 -171.35 2.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.602 179.813 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.482 ' HA ' ' HA ' ' A' ' 47' ' ' PHE . 0.0 OUTLIER -172.73 146.33 1.62 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.191 0.52 . . . . 0.0 111.018 -179.758 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.438 ' HB3' ' HD2' ' A' ' 44' ' ' PRO . 30.2 mm-40 -131.9 166.89 25.0 Favored Pre-proline 0 C--N 1.324 -0.527 0 CA-C-N 115.415 -0.811 . . . . 0.0 109.11 179.137 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' PRO . . . . . 0.438 ' HD2' ' HB3' ' A' ' 43' ' ' GLU . 71.4 Cg_exo -49.35 -20.35 3.69 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 121.764 1.643 . . . . 0.0 112.443 -179.327 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 28.9 tt0 -85.44 -76.89 0.31 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.122 179.156 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' GLY . . . . . 0.445 ' HA3' ' HA ' ' A' ' 67' ' ' GLU . . . -142.44 -156.79 6.91 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.688 -0.767 . . . . 0.0 112.645 -179.339 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.482 ' HA ' ' HA ' ' A' ' 42' ' ' LYS . 21.4 m-85 -108.17 151.05 26.44 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.607 0.718 . . . . 0.0 112.58 -179.315 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.525 HG22 ' HG2' ' A' ' 65' ' ' LYS . 63.5 t -124.61 142.61 40.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 114.543 -1.208 . . . . 0.0 110.537 -179.775 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.439 ' O ' ' HA ' ' A' ' 63' ' ' SER . . . -133.09 125.17 29.0 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.026 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -118.39 145.69 44.98 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.356 179.765 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.753 ' CB ' HD11 ' A' ' 76' ' ' LEU . . . -144.69 142.2 29.89 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.798 -0.361 . . . . 0.0 111.602 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.604 ' O ' HD13 ' A' ' 53' ' ' ILE . 9.2 m -136.14 135.6 39.38 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.582 179.735 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.647 ' O ' HG13 ' A' ' 59' ' ' VAL . 4.0 mm -132.51 133.63 59.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.709 0.29 . . . . 0.0 110.915 -179.91 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -108.98 121.81 45.92 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.529 179.386 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 28.4 p -121.67 164.99 21.49 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.1 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 20.0 Cg_exo -65.9 -11.73 32.18 Favored 'Trans proline' 0 C--N 1.343 0.288 0 C-N-CA 122.785 2.323 . . . . 0.0 112.763 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -111.06 -3.39 15.51 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 111.819 0.303 . . . . 0.0 111.819 -179.601 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 152.39 -167.2 31.34 Favored Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.467 -0.873 . . . . 0.0 112.765 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.647 HG13 ' O ' ' A' ' 53' ' ' ILE . 17.2 t -131.95 140.65 47.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.73 0.3 . . . . 0.0 111.144 -179.884 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.7 mt -117.54 153.81 32.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.889 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 13.8 p -140.42 149.62 21.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.307 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.502 ' O ' HD12 ' A' ' 76' ' ' LEU . . . -153.99 154.73 34.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.098 0.475 . . . . 0.0 111.411 -179.824 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' SER . . . . . 0.439 ' HA ' ' O ' ' A' ' 49' ' ' ALA . 0.1 OUTLIER -144.79 157.31 44.22 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.753 -179.315 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.762 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -151.87 105.16 0.28 Allowed Glycine 0 C--N 1.331 0.304 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.61 179.4 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.525 ' HG2' HG22 ' A' ' 48' ' ' VAL . 8.7 mtpt -107.62 44.73 1.06 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -178.65 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.651 ' ND1' HG21 ' A' ' 71' ' ' THR . 13.9 t-80 -76.18 156.29 33.8 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.877 0.37 . . . . 0.0 110.421 178.522 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.445 ' HA ' ' HA3' ' A' ' 46' ' ' GLY . 1.2 tt0 -60.88 -26.9 67.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.786 0.327 . . . . 0.0 111.119 179.844 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -97.59 123.93 41.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.028 0.442 . . . . 0.0 111.458 -179.292 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 17.1 ttt -48.2 -50.27 29.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.834 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' TYR . . . . . 0.404 ' HA ' HD12 ' A' ' 73' ' ' ILE . 46.4 m-85 -66.24 -36.74 83.79 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.635 -179.118 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.651 HG21 ' ND1' ' A' ' 66' ' ' HIS . 98.7 m -64.34 -42.28 96.35 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.721 0.296 . . . . 0.0 110.529 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.762 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -61.2 -47.52 85.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.37 179.442 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.604 ' CG2' HG22 ' A' ' 19' ' ' VAL . 14.7 mt -60.35 -47.11 93.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.548 179.645 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -63.96 -39.14 93.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.596 179.65 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -65.49 -44.97 85.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.469 179.576 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.753 HD11 ' CB ' ' A' ' 51' ' ' ALA . 0.2 OUTLIER -53.01 -57.84 9.0 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 179.194 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.603 HD11 HG13 ' A' ' 19' ' ' VAL . 9.3 mt -57.01 -31.97 38.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 178.824 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -59.11 -30.06 67.83 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-O 121.139 0.495 . . . . 0.0 110.324 178.458 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.483 ' HB2' ' HB1' ' A' ' 62' ' ' ALA . 3.8 mptt -84.65 -25.71 28.31 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.217 179.092 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.439 HD12 ' HA ' ' A' ' 77' ' ' ILE . 90.5 mt -62.21 -48.87 78.08 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 107.599 -1.26 . . . . 0.0 107.599 177.111 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.709 ' HA ' HD12 ' A' ' 84' ' ' LEU . 4.2 tt0 -60.22 -44.63 95.03 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 114.362 -1.29 . . . . 0.0 110.549 177.585 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 85.3 mtt180 -61.59 -31.38 71.43 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.882 -179.703 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 17.0 mt-30 -75.61 -39.78 57.39 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.936 0.398 . . . . 0.0 110.438 179.624 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.709 HD12 ' HA ' ' A' ' 81' ' ' GLU . 6.5 mt -66.09 -30.33 70.82 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.826 179.611 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -63.69 -22.64 67.01 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.908 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 5.6 mmtm . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.62 179.974 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' MET . . . . . 0.531 ' SD ' HD11 ' A' ' 23' ' ' LEU . 2.5 tpt . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.811 0.339 . . . . 0.0 110.852 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -124.24 116.49 22.76 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.484 -179.651 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 35.2 mt -118.98 125.23 74.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.396 179.389 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -134.35 162.63 31.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.907 0.384 . . . . 0.0 111.313 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.452 ' HB3' ' HB2' ' A' ' 40' ' ' LEU . 21.5 p -162.32 143.25 10.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.35 -179.744 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -102.81 -11.79 18.05 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.626 -179.452 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.03 -25.07 14.43 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 120.757 0.313 . . . . 0.0 111.132 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 1.4 mpp? -137.69 -165.98 1.87 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.871 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 13.6 tt0 -124.02 164.54 19.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.64 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.515 HG22 ' HG3' ' A' ' 16' ' ' ARG . 4.9 mm -91.2 111.32 23.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 121.075 0.464 . . . . 0.0 111.223 -179.497 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 15.1 p -98.22 152.72 38.13 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.034 179.807 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -58.5 -18.82 41.23 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.416 2.077 . . . . 0.0 111.757 179.278 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -79.19 -43.19 24.39 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.976 0.417 . . . . 0.0 110.519 179.27 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.48 ' O ' HG23 ' A' ' 19' ' ' VAL . 30.4 mt -72.26 -28.8 29.95 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.412 178.965 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.515 ' HG3' HG22 ' A' ' 11' ' ' ILE . 19.5 mtm180 -74.63 -44.98 47.83 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.569 178.797 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 19.0 tt0 -67.69 -39.25 84.44 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.761 179.094 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.534 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 78.2 t60 -60.14 -58.18 9.64 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.623 -0.431 . . . . 0.0 109.881 179.018 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.859 HG13 HD11 ' A' ' 77' ' ' ILE . 44.3 t -60.86 -47.54 92.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-O 120.714 0.293 . . . . 0.0 110.258 178.453 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.693 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -58.25 -42.74 87.07 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.204 0.446 . . . . 0.0 112.204 179.77 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.534 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 0.9 OUTLIER -59.2 -35.83 74.3 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 121.007 0.432 . . . . 0.0 110.243 -179.898 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.559 ' O ' HD12 ' A' ' 26' ' ' LEU . 5.2 mmm180 -76.09 -25.98 56.0 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.581 179.458 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.693 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 3.3 mt -68.31 -56.93 6.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.136 0.493 . . . . 0.0 110.393 179.542 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.08 -25.04 66.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.675 -179.866 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 7.8 tmtm? -79.11 -41.03 29.58 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.057 0.456 . . . . 0.0 110.506 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.559 HD12 ' O ' ' A' ' 22' ' ' ARG . 7.0 mt . . . . . 0 C--N 1.327 -0.383 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.688 179.788 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo . . . . . 0 N--CA 1.463 -0.277 0 CA-C-O 120.773 0.239 . . . . 0.0 112.022 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 2.0 t-160 -136.64 127.21 26.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.121 -179.7 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.634 HD12 ' N ' ' A' ' 38' ' ' ILE . 3.3 mp -119.58 135.24 60.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.92 179.808 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.53 ' C ' HD22 ' A' ' 40' ' ' LEU . 5.5 mt -116.54 142.94 27.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.808 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.53 HD22 ' C ' ' A' ' 39' ' ' ILE . 3.7 mm? -116.29 127.47 54.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.068 -179.867 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -123.5 -174.71 3.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.303 179.586 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.433 ' HG3' ' CD2' ' A' ' 47' ' ' PHE . 2.2 ttpp -159.99 139.35 11.05 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.282 0.563 . . . . 0.0 111.303 -179.731 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -130.9 156.07 80.56 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-N 115.091 -0.958 . . . . 0.0 109.241 179.161 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_exo -51.34 -24.39 15.77 Favored 'Trans proline' 0 N--CA 1.465 -0.186 0 C-N-CA 121.936 1.757 . . . . 0.0 112.464 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.31 -6.56 56.61 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.439 -0.8 . . . . 0.0 112.654 -179.177 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 149.82 -162.42 29.13 Favored Glycine 0 C--O 1.224 -0.483 0 C-N-CA 120.248 -0.977 . . . . 0.0 112.222 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.433 ' CD2' ' HG3' ' A' ' 42' ' ' LYS . 17.9 m-85 -110.01 154.55 23.02 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.425 0.631 . . . . 0.0 111.986 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.668 HG22 ' CB ' ' A' ' 65' ' ' LYS . 55.4 t -129.19 139.04 52.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 114.966 -1.015 . . . . 0.0 111.064 -179.297 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.403 ' O ' ' HA ' ' A' ' 63' ' ' SER . . . -129.82 123.34 30.67 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.265 179.47 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -119.08 149.67 41.29 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.718 0.294 . . . . 0.0 111.051 -179.933 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.473 ' N ' HD11 ' A' ' 76' ' ' LEU . . . -145.85 140.16 26.86 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.437 179.746 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.1 m -134.86 130.72 36.43 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.018 179.51 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.534 ' O ' HG13 ' A' ' 59' ' ' VAL . 6.7 mt -132.69 137.3 54.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 121.047 0.451 . . . . 0.0 111.68 -179.478 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -102.28 134.96 44.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.796 179.283 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 6.0 p -129.88 160.55 64.46 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.418 179.75 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_exo -67.59 -10.51 28.97 Favored 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.461 2.108 . . . . 0.0 112.687 -179.68 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -115.79 -3.94 12.18 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 111.801 0.297 . . . . 0.0 111.801 -179.697 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 159.25 -167.12 34.91 Favored Glycine 0 C--N 1.331 0.282 0 C-N-CA 120.391 -0.909 . . . . 0.0 112.82 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.534 HG13 ' O ' ' A' ' 53' ' ' ILE . 15.4 t -131.64 140.89 47.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 120.802 0.334 . . . . 0.0 111.163 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.712 HD23 ' HB3' ' A' ' 83' ' ' GLN . 6.5 mp -116.47 151.6 35.75 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.045 -179.822 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 14.1 p -139.96 149.05 22.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.147 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -154.93 150.2 27.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.302 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' SER . . . . . 0.527 ' HA ' HD12 ' A' ' 76' ' ' LEU . 0.9 OUTLIER -145.8 156.49 43.62 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.783 -179.402 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.781 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -150.04 104.6 0.28 Allowed Glycine 0 CA--C 1.519 0.335 0 N-CA-C 111.37 -0.692 . . . . 0.0 111.37 179.287 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.668 ' CB ' HG22 ' A' ' 48' ' ' VAL . 6.0 mtmt -106.93 45.11 1.0 Allowed 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -178.625 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.57 ' ND1' HG21 ' A' ' 71' ' ' THR . 12.3 t-80 -75.72 156.91 34.23 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 178.572 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.4 pm0 -60.17 -27.24 66.95 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.759 0.314 . . . . 0.0 111.263 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -98.63 118.43 35.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.975 0.417 . . . . 0.0 111.301 -179.553 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 11.5 ttt -47.43 -45.04 25.3 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.559 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 8.5 m-85 -66.7 -39.67 88.17 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.072 -179.716 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.57 HG21 ' ND1' ' A' ' 66' ' ' HIS . 93.2 m -65.41 -38.79 91.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.73 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.781 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -61.62 -50.8 71.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.758 179.644 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.61 HG21 HG22 ' A' ' 19' ' ' VAL . 6.8 mt -62.08 -41.18 90.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-O 120.741 0.305 . . . . 0.0 110.243 179.355 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -64.06 -41.72 97.26 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.923 0.392 . . . . 0.0 110.047 179.096 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 62.0 mt-10 -67.26 -41.08 86.17 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.829 179.502 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.527 HD12 ' HA ' ' A' ' 63' ' ' SER . 0.4 OUTLIER -54.64 -64.78 0.72 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.326 179.662 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.859 HD11 HG13 ' A' ' 19' ' ' VAL . 55.5 mt -55.85 -26.79 21.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.567 -0.288 . . . . 0.0 110.272 178.929 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -58.53 -39.62 80.66 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 178.066 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.16 -30.86 63.88 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.834 -1.076 . . . . 0.0 110.287 178.754 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.818 ' O ' HD12 ' A' ' 84' ' ' LEU . 90.3 mt -61.66 -45.2 95.06 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 107.61 -1.256 . . . . 0.0 107.61 177.451 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.406 ' HG3' HD22 ' A' ' 26' ' ' LEU . 21.9 tt0 -57.33 -52.57 64.83 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 114.807 -1.088 . . . . 0.0 110.287 177.332 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 39.7 mtt180 -65.18 -16.55 63.64 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.566 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' GLN . . . . . 0.712 ' HB3' HD23 ' A' ' 60' ' ' LEU . 8.2 mt-30 -75.44 -55.3 5.83 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.564 0.221 . . . . 0.0 111.067 -179.826 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.818 HD12 ' O ' ' A' ' 80' ' ' LEU . 2.5 mp -64.12 -27.68 69.25 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.089 0.471 . . . . 0.0 110.456 179.62 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -61.92 -36.27 80.87 Favored 'General case' 0 CA--C 1.521 -0.157 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.352 -179.27 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 8.4 mmtm . . . . . 0 C--N 1.327 -0.389 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.11 -179.757 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' MET . . . . . 0.71 ' CG ' HD11 ' A' ' 23' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.79 0.328 . . . . 0.0 110.944 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 39.4 t-20 -113.56 142.17 46.29 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.485 -179.689 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.639 ' CG2' HD11 ' A' ' 40' ' ' LEU . 21.2 mt -131.37 123.84 53.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.597 179.499 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.8 p -134.92 157.5 46.7 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.947 0.403 . . . . 0.0 111.31 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.46 ' HB3' HD12 ' A' ' 40' ' ' LEU . 21.7 p -163.32 143.32 8.82 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.508 -179.733 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.4 mtmt -101.05 12.56 37.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.294 -179.764 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -142.43 25.87 1.83 Allowed 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.801 179.587 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 2.4 mtm 179.37 172.51 0.89 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.859 -179.797 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 14.0 pm0 -114.9 168.41 9.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.477 179.583 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.631 HG22 ' HG3' ' A' ' 16' ' ' ARG . 6.5 mm -89.94 107.99 18.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 121.061 0.457 . . . . 0.0 111.349 -179.263 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 14.1 p -97.28 150.98 37.4 Favored Pre-proline 0 C--N 1.327 -0.389 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.831 179.714 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_endo -56.08 -26.8 61.57 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.475 2.117 . . . . 0.0 111.66 179.069 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -71.43 -44.6 64.54 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.634 179.47 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.681 ' O ' HG23 ' A' ' 19' ' ' VAL . 34.7 mt -72.19 -27.92 27.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 178.953 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.631 ' HG3' HG22 ' A' ' 11' ' ' ILE . 63.1 mtm180 -76.39 -44.63 35.3 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.776 178.778 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -67.75 -40.37 84.1 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.686 179.14 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.509 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 41.5 t-80 -60.57 -58.0 10.35 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 179.07 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.681 HG23 ' O ' ' A' ' 15' ' ' ILE . 22.0 t -60.01 -47.49 91.59 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.447 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 178.554 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.718 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -59.4 -39.66 84.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.934 179.654 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.509 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 0.9 OUTLIER -59.64 -34.75 73.2 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 121.134 0.492 . . . . 0.0 109.924 179.915 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.738 ' O ' HD12 ' A' ' 26' ' ' LEU . 36.5 mmt180 -75.55 -25.4 57.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.713 179.35 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.718 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 14.8 mt -66.98 -55.82 12.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.104 0.478 . . . . 0.0 110.083 179.199 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.57 -21.92 63.12 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.135 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -78.91 -30.58 44.92 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.119 0.485 . . . . 0.0 110.312 179.375 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.738 HD12 ' O ' ' A' ' 22' ' ' ARG . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.561 179.691 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo . . . . . 0 N--CA 1.461 -0.401 0 N-CA-C 110.966 -0.436 . . . . 0.0 110.966 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 1.4 t-160 -134.49 128.91 34.34 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.104 0.478 . . . . 0.0 112.155 -178.909 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.45 HD12 ' N ' ' A' ' 38' ' ' ILE . 4.9 mp -119.49 133.52 66.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.152 179.189 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.412 HG22 ' N ' ' A' ' 40' ' ' LEU . 38.4 mt -116.43 154.39 18.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.908 0.385 . . . . 0.0 111.51 -179.51 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.639 HD11 ' CG2' ' A' ' 4' ' ' ILE . 0.8 OUTLIER -127.28 126.01 41.89 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.711 179.773 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 3.2 m -123.18 -176.67 3.48 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.655 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.501 ' HG3' ' CE2' ' A' ' 47' ' ' PHE . 0.1 OUTLIER -158.42 138.1 11.97 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.324 0.583 . . . . 0.0 111.26 -179.63 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -130.74 155.49 81.25 Favored Pre-proline 0 C--N 1.322 -0.614 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.393 179.285 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -51.16 -24.69 15.41 Favored 'Trans proline' 0 C--O 1.232 0.221 0 C-N-CA 122.013 1.809 . . . . 0.0 112.372 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.41 -6.5 56.51 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.582 -0.736 . . . . 0.0 112.612 -179.15 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 150.12 -162.58 29.25 Favored Glycine 0 C--O 1.224 -0.477 0 C-N-CA 120.245 -0.978 . . . . 0.0 112.3 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.501 ' CE2' ' HG3' ' A' ' 42' ' ' LYS . 11.3 m-85 -109.92 155.25 21.98 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.435 0.636 . . . . 0.0 111.927 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.635 HG22 ' CB ' ' A' ' 65' ' ' LYS . 49.1 t -129.2 139.09 52.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 114.945 -1.025 . . . . 0.0 111.205 -179.198 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -130.49 122.94 28.58 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.444 179.44 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -119.64 149.77 41.43 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.828 0.347 . . . . 0.0 111.017 -179.672 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.615 ' N ' HD11 ' A' ' 76' ' ' LEU . . . -145.28 139.39 27.06 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.166 179.567 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.0 m -135.43 130.94 35.58 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.251 179.602 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.495 ' O ' HG13 ' A' ' 59' ' ' VAL . 16.1 mt -132.72 135.27 57.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 120.912 0.387 . . . . 0.0 111.412 -179.653 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -103.13 134.49 46.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.442 179.365 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.477 ' HB ' ' HD2' ' A' ' 56' ' ' PRO . 58.1 p -133.07 157.44 78.31 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.561 179.809 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' PRO . . . . . 0.477 ' HD2' ' HB ' ' A' ' 55' ' ' THR . 43.1 Cg_endo -68.31 -7.34 19.82 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.302 2.001 . . . . 0.0 112.716 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 88.5 m-20 -124.14 22.93 8.58 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.591 0.234 . . . . 0.0 111.604 -179.803 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 138.69 -165.51 25.55 Favored Glycine 0 C--N 1.331 0.294 0 C-N-CA 120.406 -0.902 . . . . 0.0 112.964 179.728 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.495 HG13 ' O ' ' A' ' 53' ' ' ILE . 21.4 t -142.4 144.53 24.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.766 0.317 . . . . 0.0 111.122 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.676 HD21 ' HG ' ' A' ' 84' ' ' LEU . 8.4 mp -118.7 142.82 47.31 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.306 -179.667 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 21.4 t -140.81 142.33 30.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.907 179.76 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.512 ' O ' HD12 ' A' ' 76' ' ' LEU . . . -153.51 154.39 34.24 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.257 0.551 . . . . 0.0 111.609 -179.708 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 80.3 p -145.09 159.55 42.79 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.828 -179.263 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.789 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -152.61 102.8 0.23 Allowed Glycine 0 C--N 1.331 0.305 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.47 179.466 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.635 ' CB ' HG22 ' A' ' 48' ' ' VAL . 0.0 OUTLIER -105.42 44.33 1.05 Allowed 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -178.771 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 12.5 t-80 -75.23 156.28 35.92 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.589 -0.278 . . . . 0.0 110.253 178.57 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -60.2 -27.25 67.01 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.727 0.299 . . . . 0.0 111.364 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 32.5 t0 -97.66 116.53 30.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.931 0.396 . . . . 0.0 111.191 -179.375 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' MET . . . . . 0.41 ' O ' HD12 ' A' ' 73' ' ' ILE . 1.4 ttt -46.92 -44.06 19.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.414 179.821 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -66.81 -42.38 85.98 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.886 -179.688 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 71.5 m -65.75 -37.51 86.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.917 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.789 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -61.96 -52.93 62.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.958 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.443 HG21 HG22 ' A' ' 19' ' ' VAL . 6.3 mt -61.6 -41.32 89.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.827 0.346 . . . . 0.0 110.235 179.505 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -63.7 -40.0 95.72 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.267 -0.424 . . . . 0.0 109.929 179.068 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -66.35 -41.6 89.3 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.478 179.293 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.711 HD23 HG13 ' A' ' 77' ' ' ILE . 0.2 OUTLIER -52.74 -62.32 1.72 Allowed 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 179.042 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.711 HG13 HD23 ' A' ' 76' ' ' LEU . 4.9 mt -55.9 -29.14 25.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 178.507 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -59.26 -30.51 68.34 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-O 121.112 0.482 . . . . 0.0 110.14 178.27 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.447 ' CE ' ' HA ' ' A' ' 79' ' ' LYS . 0.1 OUTLIER -86.9 -28.02 23.05 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.446 179.069 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.773 ' O ' HD12 ' A' ' 84' ' ' LEU . 92.5 mt -63.73 -48.82 75.51 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.048 -1.094 . . . . 0.0 108.048 177.596 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -60.21 -49.87 75.9 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 114.984 -1.007 . . . . 0.0 110.462 177.741 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 3.6 mtt180 -63.92 -25.51 68.18 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.476 -179.535 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 23.7 mt-30 -73.87 -45.93 47.95 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.811 0.339 . . . . 0.0 110.703 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.773 HD12 ' O ' ' A' ' 80' ' ' LEU . 0.9 OUTLIER -64.84 -28.61 69.67 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.799 179.835 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -62.38 -28.64 69.92 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.003 0.43 . . . . 0.0 110.308 179.619 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.331 -0.233 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.394 179.628 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.836 0.351 . . . . 0.0 110.854 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -125.31 134.61 52.18 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.236 -179.708 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.62 HG12 HD12 ' A' ' 11' ' ' ILE . 9.0 tt -135.09 125.94 45.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.349 179.72 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 3.0 p -134.76 165.33 25.53 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.901 0.381 . . . . 0.0 111.446 -179.641 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.4 ' HB3' ' HB2' ' A' ' 40' ' ' LEU . 3.2 p -161.59 130.42 4.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.978 -0.556 . . . . 0.0 109.991 -179.388 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 15.0 mtmt -99.0 13.67 31.92 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.271 -179.601 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 4.5 tp-100 -141.91 21.67 2.12 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.636 179.319 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 176.74 161.96 0.41 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.51 -179.754 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -96.62 160.28 14.47 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.21 179.39 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.62 HD12 HG12 ' A' ' 4' ' ' ILE . 3.9 mm -90.27 119.3 37.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.002 0.429 . . . . 0.0 111.202 -179.372 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.418 ' H ' HD12 ' A' ' 15' ' ' ILE . 16.8 p -100.58 157.27 34.05 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.641 179.434 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_exo -61.01 -15.08 36.74 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.477 2.118 . . . . 0.0 112.233 179.54 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -88.7 -38.72 14.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.904 0.383 . . . . 0.0 110.725 179.791 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.418 HD12 ' H ' ' A' ' 12' ' ' THR . 18.2 mt -73.57 -31.75 33.62 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 N-CA-C 109.484 -0.562 . . . . 0.0 109.484 179.028 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.412 ' O ' ' CB ' ' A' ' 20' ' ' ALA . 0.4 OUTLIER -72.55 -46.62 53.62 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.273 178.749 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -67.04 -33.64 75.97 Favored 'General case' 0 N--CA 1.456 -0.171 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.189 178.785 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.413 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 45.2 t-80 -58.85 -66.22 0.54 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.995 0.426 . . . . 0.0 109.854 178.659 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.677 HG12 HD21 ' A' ' 23' ' ' LEU . 12.2 t -61.39 -44.61 98.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.796 178.998 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.602 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -55.15 -50.13 70.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.56 179.703 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.413 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 3.1 p30 -59.02 -28.57 66.54 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-O 120.894 0.378 . . . . 0.0 110.567 -179.938 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.518 ' CB ' HD13 ' A' ' 77' ' ' ILE . 13.8 mmt180 -74.09 -28.84 61.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.447 179.349 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.677 HD21 HG12 ' A' ' 19' ' ' VAL . 1.1 mt -69.7 -47.35 63.5 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.304 179.086 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.99 -27.35 66.79 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.962 179.617 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -79.34 -31.91 43.17 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.775 179.539 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.59 HD11 ' CG2' ' A' ' 77' ' ' ILE . 10.1 mt . . . . . 0 C--N 1.328 -0.358 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.863 179.817 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo . . . . . 0 C--O 1.232 0.19 0 N-CA-C 111.854 -0.095 . . . . 0.0 111.854 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 37' ' ' HIS . . . . . 0.706 ' C ' HD12 ' A' ' 38' ' ' ILE . 19.5 t-160 -134.42 133.73 40.84 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.711 -0.396 . . . . 0.0 111.411 -179.785 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.706 HD12 ' C ' ' A' ' 37' ' ' HIS . 2.7 mp -126.17 131.09 71.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.666 179.619 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 25.1 mt -121.31 138.93 50.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.71 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.4 ' HB2' ' HB3' ' A' ' 6' ' ' SER . 10.0 mt -121.31 127.96 51.84 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.949 0.404 . . . . 0.0 110.811 179.868 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 8.5 m -125.59 -170.57 2.2 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.751 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.459 ' HA ' ' HA ' ' A' ' 47' ' ' PHE . 3.9 tttt -171.85 146.78 2.11 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.113 0.483 . . . . 0.0 110.794 -179.879 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.437 ' N ' ' HG2' ' A' ' 42' ' ' LYS . 7.2 mt-10 -131.45 169.57 13.45 Favored Pre-proline 0 C--N 1.324 -0.536 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.06 178.966 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' PRO . . . . . 0.426 ' HD2' ' HB3' ' A' ' 43' ' ' GLU . 69.1 Cg_exo -51.61 -19.96 8.32 Favored 'Trans proline' 0 N--CA 1.463 -0.307 0 C-N-CA 121.776 1.65 . . . . 0.0 112.23 -179.416 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -85.73 -76.71 0.32 Allowed 'General case' 0 N--CA 1.445 -0.708 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.309 179.379 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' GLY . . . . . 0.452 ' HA3' ' HA ' ' A' ' 67' ' ' GLU . . . -142.99 -156.75 6.88 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.766 -179.336 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.459 ' HA ' ' HA ' ' A' ' 42' ' ' LYS . 22.3 m-85 -108.06 150.61 26.95 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-O 121.65 0.738 . . . . 0.0 112.57 -179.302 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.574 HG13 ' HG2' ' A' ' 65' ' ' LYS . 62.2 t -124.78 140.76 47.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 114.477 -1.238 . . . . 0.0 110.405 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -132.19 124.41 28.96 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.672 -0.24 . . . . 0.0 110.715 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -120.65 147.04 45.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.62 -0.264 . . . . 0.0 110.67 -179.862 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.676 ' N ' HD11 ' A' ' 76' ' ' LEU . . . -145.39 142.03 28.98 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.899 0.381 . . . . 0.0 111.433 179.738 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.457 HG23 HG22 ' A' ' 61' ' ' VAL . 3.9 m -136.02 131.67 35.28 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.101 -0.5 . . . . 0.0 109.99 179.419 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.513 ' O ' HG13 ' A' ' 59' ' ' VAL . 22.0 mt -132.85 137.52 53.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 121.0 0.429 . . . . 0.0 111.344 -179.637 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -105.02 128.77 53.46 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.184 179.092 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.633 ' HB ' ' HD2' ' A' ' 56' ' ' PRO . 5.7 p -124.82 166.35 20.63 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.361 -179.895 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' PRO . . . . . 0.633 ' HD2' ' HB ' ' A' ' 55' ' ' THR . 56.7 Cg_endo -72.79 -4.08 14.72 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.228 1.952 . . . . 0.0 112.529 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 81.1 m-20 -117.98 -4.3 11.08 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.406 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 154.1 -171.93 32.72 Favored Glycine 0 C--N 1.332 0.333 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.699 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.513 HG13 ' O ' ' A' ' 53' ' ' ILE . 21.4 t -127.33 142.69 42.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.739 0.304 . . . . 0.0 111.093 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 30.1 mt -119.37 152.36 36.93 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.323 -0.398 . . . . 0.0 111.315 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.492 ' H ' HE22 ' A' ' 83' ' ' GLN . 21.6 t -141.56 143.61 27.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.815 179.735 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.411 ' O ' HD12 ' A' ' 76' ' ' LEU . . . -151.0 156.9 42.11 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.13 0.491 . . . . 0.0 111.545 -179.624 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 10.6 m -145.16 154.78 42.79 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.718 -179.326 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.754 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -148.91 100.78 0.21 Allowed Glycine 0 C--N 1.332 0.357 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.699 179.4 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.574 ' HG2' HG13 ' A' ' 48' ' ' VAL . 8.8 mttt -102.52 44.57 1.0 Allowed 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -178.838 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.62 ' ND1' HG21 ' A' ' 71' ' ' THR . 12.1 t-80 -76.36 155.3 34.23 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.78 0.324 . . . . 0.0 110.311 178.536 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.452 ' HA ' ' HA3' ' A' ' 46' ' ' GLY . 26.0 mt-10 -62.06 -26.22 68.14 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.759 0.314 . . . . 0.0 111.339 -179.871 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -97.28 121.95 39.76 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.044 0.449 . . . . 0.0 111.358 -179.395 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.6 ttt -47.51 -51.37 20.81 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.998 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 36.3 m-85 -65.91 -36.77 84.3 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.729 -179.023 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.62 HG21 ' ND1' ' A' ' 66' ' ' HIS . 94.2 m -64.23 -42.23 96.65 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.824 0.345 . . . . 0.0 110.658 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.754 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -61.51 -47.22 86.61 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.429 179.606 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.44 HG21 HG22 ' A' ' 19' ' ' VAL . 28.8 mt -59.71 -48.74 86.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.77 179.739 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 19.6 m-20 -64.03 -38.54 91.43 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.74 179.783 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -65.37 -45.66 83.22 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.606 179.726 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.676 HD11 ' N ' ' A' ' 51' ' ' ALA . 0.3 OUTLIER -54.22 -56.28 19.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.541 -0.3 . . . . 0.0 110.418 179.425 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.59 ' CG2' HD11 ' A' ' 26' ' ' LEU . 52.3 mt -57.86 -33.21 45.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 N-CA-C 110.227 -0.286 . . . . 0.0 110.227 179.231 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -58.63 -35.52 72.64 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.545 0.688 . . . . 0.0 109.781 178.641 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.4 mptp? -76.81 -27.77 55.31 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 114.83 -1.077 . . . . 0.0 110.138 179.409 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.509 HD12 ' HA ' ' A' ' 77' ' ' ILE . 96.3 mt -62.05 -50.14 73.19 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 177.472 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.462 ' HA ' HD12 ' A' ' 84' ' ' LEU . 2.5 tt0 -62.79 -46.25 88.86 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 114.277 -1.329 . . . . 0.0 110.709 177.869 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.69 -34.14 75.23 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.07 -179.588 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' GLN . . . . . 0.492 HE22 ' H ' ' A' ' 61' ' ' VAL . 37.3 mt-30 -75.39 -36.08 60.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.586 179.713 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.462 HD12 ' HA ' ' A' ' 81' ' ' GLU . 4.3 mt -64.66 -27.68 69.09 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.83 179.869 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -64.17 -26.02 68.34 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.729 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.307 0 CA-C-O 121.215 0.531 . . . . 0.0 110.85 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 2' ' ' MET . . . . . 0.688 ' HG3' HD11 ' A' ' 23' ' ' LEU . 5.9 tmm? . . . . . 0 C--O 1.231 0.084 0 CA-C-O 120.778 0.323 . . . . 0.0 110.827 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -124.0 107.15 11.0 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.369 -179.704 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 40.0 mt -109.09 126.14 66.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.619 179.546 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -133.99 162.01 33.23 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.922 0.391 . . . . 0.0 111.147 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.422 ' HB3' ' HB2' ' A' ' 40' ' ' LEU . 21.6 p -162.72 137.58 6.69 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.298 -179.586 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.4 mmtt -101.82 34.65 2.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.116 -179.569 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -141.96 -45.3 0.34 Allowed 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.942 179.711 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.41 -177.81 4.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.84 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -106.8 163.95 12.51 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.435 179.817 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 3.8 mm -90.32 118.07 34.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 121.037 0.446 . . . . 0.0 111.009 -179.557 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.401 ' HB ' ' HD2' ' A' ' 13' ' ' PRO . 16.1 p -100.84 153.99 37.42 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.854 179.648 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.401 ' HD2' ' HB ' ' A' ' 12' ' ' THR . 15.2 Cg_endo -57.37 -27.33 75.15 Favored 'Trans proline' 0 C--N 1.343 0.289 0 C-N-CA 122.417 2.078 . . . . 0.0 111.904 179.306 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -74.82 -40.41 61.08 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.934 0.397 . . . . 0.0 110.518 179.665 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 26.0 mt -73.14 -31.05 33.28 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 178.897 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.92 -46.24 58.36 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.399 178.73 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -67.61 -35.15 78.4 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.306 178.89 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.44 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 52.6 t60 -58.29 -63.56 1.22 Allowed 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 178.671 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.641 HG12 HD21 ' A' ' 23' ' ' LEU . 28.6 t -61.41 -42.9 95.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.528 -0.305 . . . . 0.0 110.258 178.58 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.646 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -56.62 -46.13 81.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.46 179.401 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.44 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 1.2 p30 -60.02 -31.88 70.36 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 120.923 0.392 . . . . 0.0 110.546 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 36.1 mmt180 -73.23 -27.11 61.41 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.613 179.66 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.688 HD11 ' HG3' ' A' ' 2' ' ' MET . 2.0 mt -68.78 -49.82 55.47 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.118 0.485 . . . . 0.0 109.994 178.966 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.21 -26.42 66.36 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.016 179.459 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 19.8 tttt -77.22 -32.74 56.1 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.726 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.749 HD11 ' CG2' ' A' ' 77' ' ' ILE . 5.1 mt . . . . . 0 C--N 1.327 -0.371 0 CA-C-O 120.845 0.355 . . . . 0.0 110.623 179.234 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo . . . . . 0 N--CA 1.463 -0.268 0 CA-C-O 120.528 0.137 . . . . 0.0 112.279 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 37' ' ' HIS . . . . . 0.665 ' C ' HD12 ' A' ' 38' ' ' ILE . 2.1 t-160 -133.95 133.71 41.7 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 121.053 -0.259 . . . . 0.0 110.492 179.634 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.665 HD12 ' C ' ' A' ' 37' ' ' HIS . 3.1 mp -129.43 129.52 67.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.895 0.379 . . . . 0.0 111.155 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.572 ' C ' HD22 ' A' ' 40' ' ' LEU . 3.9 mp -118.09 140.47 41.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.404 179.511 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.572 HD22 ' C ' ' A' ' 39' ' ' ILE . 3.5 mm? -117.91 126.66 52.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.951 0.405 . . . . 0.0 111.161 -179.636 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -123.68 -172.88 2.62 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.379 179.638 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.456 ' CE ' ' CE2' ' A' ' 47' ' ' PHE . 13.4 tttm -172.95 146.73 1.56 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.197 0.522 . . . . 0.0 111.003 -179.803 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.427 ' HB3' ' HD2' ' A' ' 44' ' ' PRO . 43.7 mt-10 -132.33 166.79 26.12 Favored Pre-proline 0 C--N 1.323 -0.583 0 CA-C-N 115.428 -0.805 . . . . 0.0 109.153 179.054 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' PRO . . . . . 0.427 ' HD2' ' HB3' ' A' ' 43' ' ' GLU . 73.7 Cg_exo -50.05 -19.75 4.45 Favored 'Trans proline' 0 N--CA 1.464 -0.236 0 C-N-CA 121.678 1.586 . . . . 0.0 112.365 -179.529 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.75 -76.25 0.34 Allowed 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 115.575 -0.738 . . . . 0.0 110.328 179.317 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' GLY . . . . . 0.452 ' HA3' ' HA ' ' A' ' 67' ' ' GLU . . . -142.72 -158.74 7.66 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.751 -179.301 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.456 ' CE2' ' CE ' ' A' ' 42' ' ' LYS . 24.2 m-85 -107.35 151.19 25.83 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 121.577 0.703 . . . . 0.0 112.433 -179.298 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.59 HG22 ' CB ' ' A' ' 65' ' ' LYS . 78.7 t -126.0 139.78 50.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 114.712 -1.131 . . . . 0.0 110.577 -179.881 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.443 ' O ' ' HA ' ' A' ' 63' ' ' SER . . . -131.03 124.44 30.88 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.642 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -120.07 148.66 43.31 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.694 0.283 . . . . 0.0 110.737 -179.969 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.802 ' CB ' HD11 ' A' ' 76' ' ' LEU . . . -145.11 142.08 29.36 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.976 0.417 . . . . 0.0 111.399 179.925 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 4.0 m -133.84 132.03 39.92 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.78 179.466 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.588 ' O ' HG13 ' A' ' 59' ' ' VAL . 13.2 mt -133.81 136.78 53.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.996 0.426 . . . . 0.0 111.516 -179.377 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -100.83 144.32 29.93 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.54 179.011 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.441 ' HB ' ' CD ' ' A' ' 56' ' ' PRO . 24.4 p -136.3 168.68 16.08 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.735 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' PRO . . . . . 0.441 ' CD ' ' HB ' ' A' ' 55' ' ' THR . 10.4 Cg_exo -71.84 -12.98 29.15 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.843 2.362 . . . . 0.0 112.705 -179.858 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -130.15 21.36 5.3 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 112.038 0.384 . . . . 0.0 112.038 -179.368 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 150.52 -164.79 29.9 Favored Glycine 0 C--N 1.33 0.223 0 C-N-CA 120.082 -1.056 . . . . 0.0 113.334 179.682 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.588 HG13 ' O ' ' A' ' 53' ' ' ILE . 12.8 t -141.7 146.55 22.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.687 0.279 . . . . 0.0 110.921 -179.868 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.568 HD22 ' HB3' ' A' ' 83' ' ' GLN . 2.8 mt -119.11 147.44 44.16 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.871 0.367 . . . . 0.0 111.271 -179.679 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 9.2 p -141.18 147.37 22.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.018 179.898 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.616 ' O ' HD12 ' A' ' 76' ' ' LEU . . . -155.23 154.41 32.15 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.078 0.466 . . . . 0.0 111.333 -179.954 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' SER . . . . . 0.443 ' HA ' ' O ' ' A' ' 49' ' ' ALA . 3.1 p -146.56 153.99 41.0 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.737 -179.41 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.755 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -147.47 107.03 0.37 Allowed Glycine 0 C--N 1.333 0.386 0 N-CA-C 111.496 -0.642 . . . . 0.0 111.496 179.199 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.59 ' CB ' HG22 ' A' ' 48' ' ' VAL . 13.6 mtpt -107.24 44.75 1.04 Allowed 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 -178.701 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.617 ' ND1' HG21 ' A' ' 71' ' ' THR . 12.8 t-80 -76.77 155.65 32.97 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.81 0.338 . . . . 0.0 110.292 178.688 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.452 ' HA ' ' HA3' ' A' ' 46' ' ' GLY . 1.3 mm-40 -61.64 -26.29 67.91 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.823 0.344 . . . . 0.0 111.185 179.819 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -98.09 123.69 42.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.367 -179.558 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 6.1 ttt -47.63 -47.43 29.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.773 -0.648 . . . . 0.0 111.796 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -66.46 -38.71 87.95 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.861 -179.016 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.617 HG21 ' ND1' ' A' ' 66' ' ' HIS . 87.8 m -63.84 -42.01 97.69 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.707 0.289 . . . . 0.0 110.76 -179.749 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.755 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -61.64 -49.0 78.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.541 179.678 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.525 HG21 HG22 ' A' ' 19' ' ' VAL . 23.1 mt -59.91 -47.54 91.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.788 179.715 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -63.39 -37.74 88.44 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.604 179.814 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -65.64 -44.1 87.46 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.575 179.57 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.802 HD11 ' CB ' ' A' ' 51' ' ' ALA . 0.3 OUTLIER -54.49 -56.8 15.1 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.269 179.323 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.749 ' CG2' HD11 ' A' ' 26' ' ' LEU . 14.1 mm -57.66 -30.31 36.78 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.493 -0.322 . . . . 0.0 110.133 179.044 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -58.32 -36.32 73.2 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.474 0.654 . . . . 0.0 109.694 178.534 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.6 ' HB2' ' HB1' ' A' ' 62' ' ' ALA . 5.7 mmtm -76.29 -30.06 57.61 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.853 -1.067 . . . . 0.0 110.375 179.365 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.559 HD22 HD12 ' A' ' 53' ' ' ILE . 31.4 mt -60.33 -49.68 76.62 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 177.477 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -61.44 -43.16 99.36 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 114.207 -1.361 . . . . 0.0 110.091 177.278 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.42 -30.6 71.34 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.55 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' GLN . . . . . 0.568 ' HB3' HD22 ' A' ' 60' ' ' LEU . 34.2 mt-30 -76.35 -40.21 51.85 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.015 0.436 . . . . 0.0 110.48 179.486 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 6.5 mt -64.98 -30.76 71.77 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.646 179.684 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 -64.3 -52.66 57.45 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.551 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 6.9 mmtm . . . . . 0 C--N 1.328 -0.334 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.48 179.52 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' MET . . . . . 0.859 ' HE1' HD11 ' A' ' 4' ' ' ILE . 8.4 tmm? . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.899 0.381 . . . . 0.0 110.886 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -103.0 124.87 49.33 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.19 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.859 HD11 ' HE1' ' A' ' 2' ' ' MET . 34.5 mt -109.89 124.01 66.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.873 179.786 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.8 p -134.09 156.7 47.81 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.059 179.741 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 22.0 p -164.37 139.79 5.89 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.614 -179.754 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 6.2 mtmp? -101.55 35.5 2.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.809 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -141.94 -50.23 0.39 Allowed 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.755 179.823 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 17.5 mtm -119.01 177.9 4.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.857 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 -104.52 164.96 11.38 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.736 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.482 HG22 ' HG3' ' A' ' 16' ' ' ARG . 4.8 mm -90.02 112.35 24.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 121.088 0.471 . . . . 0.0 111.009 -179.678 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.41 ' H ' HD12 ' A' ' 15' ' ' ILE . 19.3 p -98.92 148.69 34.91 Favored Pre-proline 0 C--N 1.326 -0.419 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.018 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_exo -55.3 -21.06 27.53 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.325 2.017 . . . . 0.0 111.69 179.148 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -76.12 -42.81 45.82 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.051 0.453 . . . . 0.0 110.317 179.255 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.622 ' O ' HG23 ' A' ' 19' ' ' VAL . 24.6 mt -72.41 -29.02 29.92 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.34 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.489 178.985 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.482 ' HG3' HG22 ' A' ' 11' ' ' ILE . 79.4 mtt180 -74.67 -45.19 46.19 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.575 -0.739 . . . . 0.0 109.74 178.773 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 3.3 tm0? -67.38 -38.89 85.44 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.564 179.022 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.487 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 78.3 t60 -59.75 -60.58 3.61 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 178.975 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.622 HG23 ' O ' ' A' ' 15' ' ' ILE . 15.1 t -60.45 -46.94 94.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 C-N-CA 121.014 -0.274 . . . . 0.0 110.31 178.733 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.69 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -58.1 -41.58 83.81 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.887 179.7 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.487 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 0.9 OUTLIER -59.59 -34.37 72.64 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.006 0.431 . . . . 0.0 110.064 179.9 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 9.0 mmt180 -74.81 -25.98 59.41 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.747 179.551 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.69 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 10.1 mt -68.85 -57.41 5.59 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.285 0.564 . . . . 0.0 110.521 179.388 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.15 -25.76 65.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.291 -0.868 . . . . 0.0 111.566 -179.777 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 10.1 tppt? -78.64 -32.57 47.37 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.039 0.447 . . . . 0.0 110.29 179.674 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 44.4 mt . . . . . 0 C--N 1.327 -0.379 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.836 -179.957 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.514 ' HB3' HG23 ' A' ' 53' ' ' ILE . 72.4 Cg_endo . . . . . 0 N--CA 1.465 -0.161 0 CA-C-O 120.72 0.217 . . . . 0.0 111.896 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' HIS . . . . . 0.497 ' O ' HD13 ' A' ' 38' ' ' ILE . 1.5 t-160 -137.36 131.11 31.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.043 0.449 . . . . 0.0 111.369 -179.596 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.709 HD12 ' CB ' ' A' ' 51' ' ' ALA . 8.5 mm -121.0 134.31 64.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.703 179.766 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.42 ' O ' HD23 ' A' ' 40' ' ' LEU . 23.3 mt -120.85 142.27 37.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.026 -179.853 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.42 HD23 ' O ' ' A' ' 39' ' ' ILE . 10.3 mt -121.29 128.31 52.21 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.78 -179.973 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.3 m -124.65 -171.53 2.37 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.492 179.813 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.408 ' HG3' ' CD2' ' A' ' 47' ' ' PHE . 7.5 ttpp -160.41 141.18 11.88 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.339 0.59 . . . . 0.0 111.353 -179.739 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -131.49 157.47 78.04 Favored Pre-proline 0 C--N 1.322 -0.593 0 CA-C-N 115.089 -0.959 . . . . 0.0 109.27 179.25 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_exo -52.41 -24.49 21.8 Favored 'Trans proline' 0 N--CA 1.464 -0.235 0 C-N-CA 121.808 1.672 . . . . 0.0 112.371 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -89.48 -6.83 56.1 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.433 -0.803 . . . . 0.0 112.766 -179.081 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 150.12 -163.87 29.55 Favored Glycine 0 C--O 1.224 -0.493 0 C-N-CA 120.239 -0.982 . . . . 0.0 112.16 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.408 ' CD2' ' HG3' ' A' ' 42' ' ' LYS . 18.7 m-85 -109.19 154.02 22.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.529 0.68 . . . . 0.0 111.959 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.563 HG22 ' CB ' ' A' ' 65' ' ' LYS . 74.6 t -127.72 139.73 51.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 114.858 -1.065 . . . . 0.0 111.042 -179.204 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -130.94 122.83 27.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.38 179.481 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -118.64 149.48 41.32 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.709 0.29 . . . . 0.0 110.807 -179.813 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.709 ' CB ' HD12 ' A' ' 38' ' ' ILE . . . -144.31 139.38 28.52 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.234 179.787 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.7 m -133.78 131.44 39.33 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 179.393 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.706 ' O ' HG13 ' A' ' 59' ' ' VAL . 19.0 mt -133.05 136.6 55.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 121.146 0.498 . . . . 0.0 111.729 -179.226 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -101.79 119.06 38.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.688 179.38 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 9.3 p -112.46 155.89 43.06 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.529 179.717 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -63.01 -14.08 39.24 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.521 2.148 . . . . 0.0 112.576 -179.806 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 61.8 m-80 -120.38 22.23 11.38 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 111.709 0.262 . . . . 0.0 111.709 -179.605 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 139.33 -167.14 25.32 Favored Glycine 0 N--CA 1.453 -0.212 0 C-N-CA 120.446 -0.883 . . . . 0.0 112.85 179.707 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.706 HG13 ' O ' ' A' ' 53' ' ' ILE . 16.6 t -137.59 142.33 36.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.82 0.343 . . . . 0.0 111.04 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.598 HD12 ' C ' ' A' ' 59' ' ' VAL . 7.6 mp -116.34 153.54 31.81 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.104 -179.84 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 21.6 t -140.26 147.15 23.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.067 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -153.77 151.69 29.86 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.023 0.439 . . . . 0.0 111.576 -179.881 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -145.18 155.24 43.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.664 -179.342 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.698 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -148.67 104.53 0.28 Allowed Glycine 0 C--N 1.333 0.367 0 N-CA-C 111.399 -0.681 . . . . 0.0 111.399 179.32 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.563 ' CB ' HG22 ' A' ' 48' ' ' VAL . 10.7 mttm -106.87 45.5 0.98 Allowed 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -178.604 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.535 ' ND1' HG21 ' A' ' 71' ' ' THR . 14.6 t-80 -75.47 156.26 35.4 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 178.474 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -59.97 -27.56 66.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.752 0.311 . . . . 0.0 111.218 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -97.97 119.89 37.41 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.985 0.421 . . . . 0.0 111.475 -179.343 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' MET . . . . . 0.437 ' HE1' HD13 ' A' ' 15' ' ' ILE . 1.2 ttt -47.73 -46.27 29.71 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.502 179.732 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 45.6 m-85 -66.57 -39.51 88.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.127 -179.556 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.535 HG21 ' ND1' ' A' ' 66' ' ' HIS . 92.4 m -65.42 -38.56 90.27 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.668 179.87 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.698 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -62.03 -50.64 71.23 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.825 179.772 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.459 HG21 HG22 ' A' ' 19' ' ' VAL . 7.3 mt -61.34 -42.01 92.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.698 0.285 . . . . 0.0 110.249 179.518 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.3 t30 -64.53 -40.74 96.17 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.13 0.491 . . . . 0.0 109.965 178.862 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -65.41 -44.58 87.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.57 179.438 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.607 HD11 ' N ' ' A' ' 51' ' ' ALA . 0.3 OUTLIER -52.38 -59.91 3.85 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 179.119 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.573 HD13 HD12 ' A' ' 80' ' ' LEU . 1.9 mm -55.92 -28.7 24.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 178.503 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.52 -41.69 90.55 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.395 0.617 . . . . 0.0 109.433 178.243 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.32 -30.87 65.17 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.987 -1.006 . . . . 0.0 110.191 178.898 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.624 ' O ' HD12 ' A' ' 84' ' ' LEU . 96.9 mt -62.74 -46.51 87.72 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 177.43 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.27 -45.7 92.4 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 114.674 -1.148 . . . . 0.0 110.253 177.556 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.97 -35.71 81.59 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.529 -179.528 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -73.65 -46.87 44.08 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.893 0.378 . . . . 0.0 110.361 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.624 HD12 ' O ' ' A' ' 80' ' ' LEU . 1.5 mt -64.69 -27.67 69.08 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.405 179.387 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -61.15 -46.98 88.32 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.151 -179.575 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 5.4 mtmm . . . . . 0 C--N 1.326 -0.456 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.976 179.649 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' MET . . . . . 0.769 ' HG3' HD11 ' A' ' 23' ' ' LEU . 6.1 tmm? . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.835 0.35 . . . . 0.0 110.909 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -120.34 124.38 45.41 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.165 -179.863 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 49.2 mt -120.39 125.95 74.72 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.849 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -132.87 160.66 36.33 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.986 179.729 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.405 ' HB3' ' HB2' ' A' ' 40' ' ' LEU . 21.9 p -163.35 142.02 8.14 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.745 -179.468 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.7 mmtm -103.92 16.15 26.98 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.353 -179.795 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 17.6 mt-30 -141.92 23.02 2.09 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 120.791 0.329 . . . . 0.0 111.031 179.785 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 176.46 -178.26 0.15 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.654 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -121.12 163.04 19.02 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.784 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 3.8 mm -91.18 118.19 35.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.937 0.398 . . . . 0.0 110.877 -179.748 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.493 ' H ' HD12 ' A' ' 15' ' ' ILE . 19.2 p -100.21 159.26 30.27 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.871 179.739 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.431 ' HA ' ' HG2' ' A' ' 16' ' ' ARG . 24.1 Cg_exo -62.58 -13.3 32.73 Favored 'Trans proline' 0 C--N 1.344 0.291 0 C-N-CA 122.611 2.207 . . . . 0.0 112.215 179.479 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -90.23 -38.59 13.33 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.025 0.441 . . . . 0.0 110.678 179.537 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.493 HD12 ' H ' ' A' ' 12' ' ' THR . 19.3 mt -72.89 -32.38 39.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.758 -0.656 . . . . 0.0 109.513 179.194 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.431 ' HG2' ' HA ' ' A' ' 13' ' ' PRO . 23.2 ptt180 -71.54 -45.73 61.53 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.538 178.86 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.41 ' N ' ' CG ' ' A' ' 16' ' ' ARG . 6.0 tp-100 -67.02 -35.85 80.82 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.492 179.014 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.453 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 68.0 t60 -58.3 -64.03 1.06 Allowed 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 178.682 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.946 HG13 HD11 ' A' ' 77' ' ' ILE . 15.2 t -61.43 -45.32 98.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.663 178.866 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.633 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -55.52 -49.28 73.04 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.678 179.751 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.453 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 3.0 p30 -59.13 -29.24 67.26 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.822 0.344 . . . . 0.0 110.641 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 41.8 mmt180 -74.77 -28.03 60.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.528 179.339 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.769 HD11 ' HG3' ' A' ' 2' ' ' MET . 1.3 mt -68.85 -48.55 63.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.964 0.412 . . . . 0.0 110.102 178.794 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.97 -26.25 65.86 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.793 179.473 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 15.6 tttp -78.51 -32.04 47.89 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.649 179.492 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.642 HD23 ' OE2' ' A' ' 81' ' ' GLU . 5.4 mt . . . . . 0 C--N 1.327 -0.377 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.713 179.695 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.725 ' HB3' HG23 ' A' ' 53' ' ' ILE . 94.5 Cg_endo . . . . . 0 N--CA 1.454 -0.847 0 N-CA-C 109.92 -0.838 . . . . 0.0 109.92 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' HIS . . . . . 0.568 ' C ' HD13 ' A' ' 38' ' ' ILE . 0.5 OUTLIER -98.63 130.47 45.15 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -177.877 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.626 HD12 ' HB1' ' A' ' 51' ' ' ALA . 5.5 mm -121.48 132.65 70.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.342 -0.844 . . . . 0.0 109.766 178.976 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 26.6 mt -119.96 148.08 23.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 121.0 0.428 . . . . 0.0 111.868 -179.232 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.405 ' HB2' ' HB3' ' A' ' 6' ' ' SER . 4.6 mt -123.38 127.18 48.1 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.629 179.59 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -124.8 -170.76 2.22 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.725 -179.889 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.459 ' HA ' ' HA ' ' A' ' 47' ' ' PHE . 1.6 tttp -170.5 145.05 2.53 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.304 0.574 . . . . 0.0 110.932 -179.786 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.456 ' N ' ' HG2' ' A' ' 42' ' ' LYS . 3.3 mm-40 -130.24 163.87 44.88 Favored Pre-proline 0 C--N 1.323 -0.576 0 CA-C-N 115.457 -0.792 . . . . 0.0 108.927 178.871 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' PRO . . . . . 0.422 ' HD2' ' HB3' ' A' ' 43' ' ' GLU . 5.0 Cg_endo -48.14 -21.96 3.32 Favored 'Trans proline' 0 N--CA 1.463 -0.287 0 C-N-CA 122.073 1.848 . . . . 0.0 112.166 -179.359 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -83.73 -75.15 0.34 Allowed 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.212 179.291 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' GLY . . . . . 0.469 ' HA3' ' HA ' ' A' ' 67' ' ' GLU . . . -143.89 -156.67 6.88 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.814 -179.31 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.459 ' HA ' ' HA ' ' A' ' 42' ' ' LYS . 22.8 m-85 -107.69 151.38 25.75 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.654 0.74 . . . . 0.0 112.476 -179.32 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.545 HG13 ' HG2' ' A' ' 65' ' ' LYS . 78.6 t -124.46 140.93 46.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 114.525 -1.216 . . . . 0.0 110.424 -179.875 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.439 ' O ' ' HA ' ' A' ' 63' ' ' SER . . . -132.08 125.1 30.55 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.64 -0.255 . . . . 0.0 110.922 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 -117.77 148.58 41.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.465 179.652 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.728 ' HB2' HD21 ' A' ' 76' ' ' LEU . . . -144.58 142.52 30.23 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.968 0.413 . . . . 0.0 111.771 -179.802 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.1 m -135.26 131.32 36.45 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.839 179.334 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.725 HG23 ' HB3' ' A' ' 36' ' ' PRO . 21.3 mt -133.35 138.84 50.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.119 0.485 . . . . 0.0 111.842 -179.159 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 18.9 m120 -102.28 119.18 38.37 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.648 179.3 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.501 ' HB ' ' HD2' ' A' ' 56' ' ' PRO . 6.1 p -113.82 162.35 23.14 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.295 179.673 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' PRO . . . . . 0.501 ' HD2' ' HB ' ' A' ' 55' ' ' THR . 68.9 Cg_endo -76.22 -3.17 13.49 Favored 'Trans proline' 0 N--CA 1.463 -0.318 0 C-N-CA 122.211 1.94 . . . . 0.0 112.517 -179.857 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -129.63 23.47 5.44 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.202 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 140.4 -167.4 25.52 Favored Glycine 0 C--N 1.33 0.239 0 C-N-CA 120.54 -0.838 . . . . 0.0 112.778 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 21.3 t -131.55 147.27 32.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.766 0.317 . . . . 0.0 111.11 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 13.0 mt -120.65 141.97 49.87 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.29 -179.767 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 21.7 t -141.21 139.96 32.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.758 179.74 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.539 ' HB1' ' HB2' ' A' ' 79' ' ' LYS . . . -151.42 159.5 44.2 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.296 0.569 . . . . 0.0 111.857 -179.557 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' SER . . . . . 0.439 ' HA ' ' O ' ' A' ' 49' ' ' ALA . 2.4 p -145.58 154.89 42.66 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.281 -0.872 . . . . 0.0 111.678 -179.306 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.715 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -148.31 105.05 0.3 Allowed Glycine 0 C--N 1.332 0.358 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.551 179.341 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.545 ' HG2' HG13 ' A' ' 48' ' ' VAL . 5.3 mttp -105.97 44.9 1.0 Allowed 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 112.401 0.519 . . . . 0.0 112.401 -178.683 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.634 ' ND1' HG21 ' A' ' 71' ' ' THR . 12.6 t-80 -76.64 155.69 33.26 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.757 0.313 . . . . 0.0 110.309 178.582 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.469 ' HA ' ' HA3' ' A' ' 46' ' ' GLY . 10.8 mt-10 -61.63 -26.34 67.94 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.787 0.327 . . . . 0.0 111.223 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -97.61 122.63 40.91 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.083 0.468 . . . . 0.0 111.475 -179.364 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' MET . . . . . 0.565 ' HE3' HD11 ' A' ' 73' ' ' ILE . 0.9 OUTLIER -47.71 -49.91 26.59 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.772 179.955 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 40.3 m-85 -66.19 -37.45 85.63 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.711 -179.087 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.634 HG21 ' ND1' ' A' ' 66' ' ' HIS . 94.1 m -64.22 -41.61 96.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.774 0.321 . . . . 0.0 110.655 -179.859 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.715 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -61.83 -47.91 82.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.491 179.455 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.565 HD11 ' HE3' ' A' ' 69' ' ' MET . 31.0 mt -60.19 -48.08 89.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.624 179.715 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -64.05 -39.78 94.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.752 179.767 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -65.12 -44.34 89.03 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.536 179.678 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.728 HD21 ' HB2' ' A' ' 51' ' ' ALA . 0.3 OUTLIER -54.21 -57.6 10.54 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.504 -0.317 . . . . 0.0 110.373 179.397 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.946 HD11 HG13 ' A' ' 19' ' ' VAL . 61.6 mt -56.63 -30.88 33.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 N-CA-C 110.162 -0.311 . . . . 0.0 110.162 179.218 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -58.66 -36.55 74.32 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.513 0.673 . . . . 0.0 109.571 178.403 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.539 ' HB2' ' HB1' ' A' ' 62' ' ' ALA . 0.0 OUTLIER -75.6 -28.04 58.75 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.8 -1.091 . . . . 0.0 110.024 179.258 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.639 ' O ' HD12 ' A' ' 84' ' ' LEU . 77.7 mt -62.79 -49.6 74.34 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 177.438 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.642 ' OE2' HD23 ' A' ' 26' ' ' LEU . 3.4 tt0 -62.68 -46.13 89.6 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 114.293 -1.321 . . . . 0.0 110.744 177.87 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.74 -37.53 86.93 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.939 -179.433 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 44.3 mt-30 -75.71 -37.7 59.2 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.884 0.373 . . . . 0.0 110.803 179.88 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.639 HD12 ' O ' ' A' ' 80' ' ' LEU . 2.2 mt -64.24 -25.37 68.03 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.695 179.668 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -64.15 -28.0 69.46 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.538 179.661 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 16.2 mmtt . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.102 179.989 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' MET . . . . . 0.493 ' CE ' ' HB2' ' A' ' 20' ' ' ALA . 3.2 mpp? . . . . . 0 C--O 1.232 0.143 0 CA-C-O 120.847 0.356 . . . . 0.0 110.916 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 3' ' ' ASN . . . . . 0.406 ' HB3' ' CD2' ' A' ' 37' ' ' HIS . 2.0 m-80 -122.91 114.27 20.22 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.26 -179.932 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 36.4 mt -123.55 123.86 68.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.68 179.617 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -134.99 157.5 46.78 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.998 0.428 . . . . 0.0 111.366 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 22.4 p -164.69 139.59 5.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.436 -179.761 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -102.03 25.31 8.9 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.188 -179.736 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -140.89 15.53 2.3 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.164 179.648 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER 173.72 -177.33 0.08 Allowed 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.984 0.421 . . . . 0.0 110.74 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -110.69 172.51 6.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.651 179.838 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.8 mm -91.01 113.22 26.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 121.009 0.433 . . . . 0.0 111.173 -179.579 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 12.5 p -98.83 157.39 34.24 Favored Pre-proline 0 C--N 1.327 -0.405 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.959 179.809 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.429 ' HA ' ' HG2' ' A' ' 16' ' ' ARG . 23.9 Cg_exo -62.55 -13.51 33.9 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.579 2.186 . . . . 0.0 111.984 179.204 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -86.1 -41.01 15.11 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.058 0.456 . . . . 0.0 110.428 179.397 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.702 ' O ' HG23 ' A' ' 19' ' ' VAL . 24.5 mt -72.7 -29.29 29.72 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.29 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.813 179.265 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.429 ' HG2' ' HA ' ' A' ' 13' ' ' PRO . 2.2 ptm180 -74.99 -43.4 54.15 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.868 -0.605 . . . . 0.0 109.544 178.935 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -67.39 -37.94 83.91 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.696 178.922 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.463 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 82.1 t60 -60.63 -53.65 54.86 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 178.55 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.798 ' O ' ' HG3' ' A' ' 22' ' ' ARG . 23.9 t -62.55 -49.28 84.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.209 178.312 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.551 ' HA ' ' CG ' ' A' ' 23' ' ' LEU . . . -55.65 -37.91 68.85 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.759 -0.376 . . . . 0.0 111.875 179.762 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.463 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 0.9 OUTLIER -64.37 -32.53 74.18 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.37 -0.532 . . . . 0.0 110.477 179.335 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.798 ' HG3' ' O ' ' A' ' 19' ' ' VAL . 0.0 OUTLIER -77.9 -39.72 42.14 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.914 -0.585 . . . . 0.0 112.486 -179.283 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.65 ' CD2' HG12 ' A' ' 19' ' ' VAL . 0.0 OUTLIER -65.24 -48.51 73.04 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 120.034 -0.666 . . . . 0.0 110.843 -179.463 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.31 -24.79 66.68 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.15 179.556 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 2.9 tppp? -79.14 -34.29 43.39 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.854 179.888 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.563 HD12 ' HD2' ' A' ' 22' ' ' ARG . 0.8 OUTLIER . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.908 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.403 ' HB3' HG23 ' A' ' 53' ' ' ILE . 69.4 Cg_endo . . . . . 0 N--CA 1.463 -0.289 0 N-CA-C 111.433 -0.257 . . . . 0.0 111.433 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' HIS . . . . . 0.406 ' CD2' ' HB3' ' A' ' 3' ' ' ASN . 2.2 t-160 -134.4 130.97 37.65 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.125 0.488 . . . . 0.0 111.635 -179.455 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 9.1 mm -120.13 133.76 65.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.388 179.495 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 2.1 mp -119.11 146.26 24.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.002 -179.815 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 45.8 mt -124.13 126.85 46.88 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.888 179.909 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -123.65 -173.93 2.86 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.398 179.696 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.409 ' HG3' ' CD2' ' A' ' 47' ' ' PHE . 15.1 tttt -159.7 140.66 12.45 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.425 0.631 . . . . 0.0 111.489 -179.667 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -131.58 156.82 79.62 Favored Pre-proline 0 C--N 1.323 -0.566 0 CA-C-N 114.934 -1.03 . . . . 0.0 109.195 179.15 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_exo -52.12 -24.47 20.15 Favored 'Trans proline' 0 N--CA 1.465 -0.183 0 C-N-CA 121.854 1.703 . . . . 0.0 112.418 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -89.64 -6.71 55.93 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.499 -0.773 . . . . 0.0 112.833 -179.178 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 149.94 -164.35 29.57 Favored Glycine 0 C--O 1.224 -0.503 0 C-N-CA 120.214 -0.993 . . . . 0.0 112.154 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.41 ' CD1' ' N ' ' A' ' 47' ' ' PHE . 18.3 m-85 -108.35 153.63 22.99 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.57 0.7 . . . . 0.0 111.854 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.623 HG22 ' CG ' ' A' ' 65' ' ' LYS . 54.1 t -127.36 140.7 48.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 114.82 -1.082 . . . . 0.0 111.023 -179.281 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -131.84 124.11 28.92 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.677 179.682 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 67.8 m-20 -118.89 147.33 44.11 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.685 0.278 . . . . 0.0 110.743 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.6 ' CB ' HD11 ' A' ' 76' ' ' LEU . . . -144.97 141.19 28.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.875 0.369 . . . . 0.0 111.547 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.629 ' O ' HD13 ' A' ' 53' ' ' ILE . 6.4 m -135.29 133.49 38.94 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.361 179.576 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.648 ' O ' HG13 ' A' ' 59' ' ' VAL . 1.1 mm -132.31 134.38 59.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.843 0.354 . . . . 0.0 111.13 -179.825 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 23.7 m120 -103.24 118.29 36.45 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.438 179.026 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 30.3 p -113.61 153.98 45.73 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.877 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_exo -61.87 -15.46 43.02 Favored 'Trans proline' 0 C--N 1.343 0.263 0 C-N-CA 122.564 2.176 . . . . 0.0 112.655 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 6.6 m120 -118.89 21.98 12.17 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.616 -0.265 . . . . 0.0 111.691 -179.546 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 141.84 -165.46 26.52 Favored Glycine 0 C--N 1.33 0.243 0 C-N-CA 120.376 -0.916 . . . . 0.0 113.053 179.756 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.648 HG13 ' O ' ' A' ' 53' ' ' ILE . 12.5 t -142.24 142.29 27.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.822 0.344 . . . . 0.0 111.02 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -117.64 148.99 41.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.192 -179.792 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 12.4 t -138.87 145.6 27.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.874 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.479 ' O ' HD12 ' A' ' 76' ' ' LEU . . . -153.43 150.97 29.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.168 0.509 . . . . 0.0 111.604 -179.723 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 11.5 p -143.04 158.7 43.36 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.643 -179.41 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.56 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -153.46 109.77 0.42 Allowed Glycine 0 C--N 1.33 0.232 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.61 179.639 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.623 ' CG ' HG22 ' A' ' 48' ' ' VAL . 60.7 mttt -110.68 45.14 1.17 Allowed 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -178.954 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 12.3 t-80 -75.79 156.36 34.61 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 110.207 -0.294 . . . . 0.0 110.207 178.543 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -61.1 -26.7 67.84 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.72 0.295 . . . . 0.0 111.295 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -98.53 120.8 39.57 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.023 0.439 . . . . 0.0 111.371 -179.378 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 13.2 ttt -48.04 -50.72 26.94 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.953 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -65.56 -40.23 92.6 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.268 -179.296 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 37.9 m -64.74 -40.44 95.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.801 0.334 . . . . 0.0 110.679 179.891 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.56 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -62.17 -49.36 76.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.648 179.506 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 12.9 mt -60.4 -45.1 97.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.878 0.37 . . . . 0.0 110.266 179.512 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -64.45 -37.82 88.85 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.261 179.264 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -65.85 -42.23 90.71 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.183 179.233 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.6 HD11 ' CB ' ' A' ' 51' ' ' ALA . 0.3 OUTLIER -53.57 -56.24 18.78 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 178.4 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.54 HD13 ' CG ' ' A' ' 22' ' ' ARG . 37.4 mt -56.79 -30.63 33.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.17 178.493 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -57.93 -35.77 71.55 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.548 0.69 . . . . 0.0 109.305 178.241 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.3 mptp? -78.92 -31.27 45.16 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 114.7 -1.136 . . . . 0.0 110.208 179.065 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.501 HD12 ' HA ' ' A' ' 77' ' ' ILE . 76.4 mt -63.07 -50.39 70.76 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 177.775 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -60.46 -47.6 85.42 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 114.942 -1.027 . . . . 0.0 110.22 177.522 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 59.7 mtt180 -62.96 -24.57 67.95 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.819 179.97 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 7.2 mt-30 -75.44 -44.24 45.4 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.615 179.757 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 28.3 mt -64.79 -27.4 68.86 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.835 179.866 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -63.55 -33.06 74.76 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.018 0.437 . . . . 0.0 110.549 179.75 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 18.6 mmtt . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.966 179.907 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' MET . . . . . 0.722 ' CE ' HD11 ' A' ' 4' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.812 0.339 . . . . 0.0 111.054 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -116.7 136.43 52.97 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.483 -179.497 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.722 HD11 ' CE ' ' A' ' 2' ' ' MET . 34.7 mt -126.27 125.39 67.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.408 179.386 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.455 ' OG1' HD13 ' A' ' 39' ' ' ILE . 2.9 p -134.35 161.2 35.65 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.869 0.366 . . . . 0.0 111.18 179.949 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 29.1 p -163.38 138.3 6.33 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.551 -179.45 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 20.3 mttt -101.74 31.48 3.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.931 -179.769 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -141.19 -47.48 0.39 Allowed 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.805 179.743 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 1.5 mpp? -120.37 -170.36 1.97 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.748 179.859 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -118.41 164.96 14.47 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.572 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.467 ' CD1' HG22 ' A' ' 4' ' ' ILE . 4.1 mm -89.95 115.1 28.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 121.073 0.463 . . . . 0.0 110.945 -179.576 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.546 ' H ' HD12 ' A' ' 15' ' ' ILE . 20.1 p -100.35 155.81 35.97 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.924 179.79 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_exo -59.56 -17.51 42.03 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.39 2.06 . . . . 0.0 111.822 179.147 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.01 -40.47 22.06 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-O 121.108 0.48 . . . . 0.0 110.226 179.21 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.546 HD12 ' H ' ' A' ' 12' ' ' THR . 19.1 mt -73.42 -28.72 25.88 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.594 179.019 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.57 -45.01 48.12 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.169 178.819 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 42.9 tt0 -67.74 -37.32 82.01 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.371 178.809 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.427 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 57.6 t60 -59.29 -60.02 4.53 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 178.648 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.544 HG23 ' O ' ' A' ' 15' ' ' ILE . 21.3 t -60.77 -45.36 97.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 110.142 -0.318 . . . . 0.0 110.142 178.396 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.681 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -57.65 -42.07 82.72 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.538 179.394 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.427 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 0.9 OUTLIER -59.67 -33.23 71.29 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 121.075 0.464 . . . . 0.0 110.043 179.607 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 19.8 mmm180 -74.15 -26.07 60.1 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.516 179.316 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.681 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 14.7 mt -66.44 -53.12 39.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.016 0.436 . . . . 0.0 109.942 178.988 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.77 -22.25 63.89 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.757 179.057 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 6.5 tptp -78.8 -28.08 44.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.15 179.191 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 33.5 mt . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.824 -179.844 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.457 ' HG2' ' HA ' ' A' ' 2' ' ' MET . 19.4 Cg_endo . . . . . 0 C--O 1.231 0.155 0 CA-C-O 120.356 0.065 . . . . 0.0 112.052 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -140.11 126.95 20.63 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.549 -0.46 . . . . 0.0 111.865 -179.814 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.638 HD12 ' N ' ' A' ' 38' ' ' ILE . 3.4 mp -119.34 138.35 50.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.418 179.323 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.455 HD13 ' OG1' ' A' ' 5' ' ' THR . 22.1 mm -116.05 148.38 18.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.46 -179.485 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 11.0 mt -122.88 127.19 48.65 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.518 179.615 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 11.7 m -125.33 -171.16 2.31 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.789 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.46 ' HA ' ' HA ' ' A' ' 47' ' ' PHE . 5.2 ttpt -173.58 146.63 1.34 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.128 0.49 . . . . 0.0 110.765 -179.791 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.443 ' HB3' ' HD2' ' A' ' 44' ' ' PRO . 2.1 mt-10 -132.04 170.5 11.15 Favored Pre-proline 0 C--N 1.324 -0.506 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.299 179.228 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' PRO . . . . . 0.443 ' HD2' ' HB3' ' A' ' 43' ' ' GLU . 69.0 Cg_exo -51.45 -19.7 7.43 Favored 'Trans proline' 0 N--CA 1.464 -0.241 0 C-N-CA 121.727 1.618 . . . . 0.0 112.302 -179.502 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.12 -77.95 0.29 Allowed 'General case' 0 N--CA 1.445 -0.724 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.104 179.344 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' GLY . . . . . 0.452 ' HA3' ' HA ' ' A' ' 67' ' ' GLU . . . -141.77 -155.68 6.55 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.859 -179.309 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.46 ' HA ' ' HA ' ' A' ' 42' ' ' LYS . 21.9 m-85 -108.94 151.13 26.72 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-O 121.639 0.733 . . . . 0.0 112.699 -179.232 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.519 HG22 ' CB ' ' A' ' 65' ' ' LYS . 75.7 t -124.98 141.45 45.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 114.482 -1.236 . . . . 0.0 110.517 -179.659 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.402 ' O ' ' HA ' ' A' ' 63' ' ' SER . . . -132.44 124.09 27.94 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.654 -0.248 . . . . 0.0 110.797 179.787 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 21.2 m-20 -119.04 149.19 42.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.602 -0.272 . . . . 0.0 110.547 179.858 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.467 ' N ' HD11 ' A' ' 76' ' ' LEU . . . -146.69 140.42 25.92 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.829 0.347 . . . . 0.0 111.317 179.849 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.6 m -135.12 131.56 37.02 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.033 179.402 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.675 ' O ' HG13 ' A' ' 59' ' ' VAL . 17.4 mt -133.33 136.4 54.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 121.013 0.435 . . . . 0.0 111.456 -179.547 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -103.6 131.28 50.88 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.148 178.963 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.573 ' HB ' ' HD2' ' A' ' 56' ' ' PRO . 5.8 p -127.83 163.33 43.98 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.444 -179.904 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' PRO . . . . . 0.573 ' HD2' ' HB ' ' A' ' 55' ' ' THR . 53.6 Cg_endo -70.83 -5.67 17.41 Favored 'Trans proline' 0 C--N 1.343 0.25 0 C-N-CA 122.321 2.014 . . . . 0.0 112.687 179.921 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 67.7 m-80 -124.82 22.12 8.19 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.685 -0.234 . . . . 0.0 111.379 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 133.68 -167.76 23.46 Favored Glycine 0 C--N 1.33 0.212 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.784 179.774 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.675 HG13 ' O ' ' A' ' 53' ' ' ILE . 14.1 t -137.24 144.7 31.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 120.665 0.269 . . . . 0.0 111.008 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.567 HD22 ' HG ' ' A' ' 84' ' ' LEU . 3.7 mp -119.34 152.4 36.82 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.108 -179.97 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.435 ' O ' ' NE2' ' A' ' 83' ' ' GLN . 9.3 p -143.0 145.36 22.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.866 179.7 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -152.01 156.82 40.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.054 0.454 . . . . 0.0 111.814 -179.652 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' SER . . . . . 0.438 ' HA ' HD12 ' A' ' 76' ' ' LEU . 4.0 m -145.04 156.05 43.71 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.858 -179.155 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.606 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -150.15 105.38 0.29 Allowed Glycine 0 CA--C 1.519 0.324 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.445 179.355 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.519 ' CB ' HG22 ' A' ' 48' ' ' VAL . 2.1 mtpp -108.68 45.9 1.0 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.57 0.581 . . . . 0.0 112.57 -178.618 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.605 ' ND1' HG21 ' A' ' 71' ' ' THR . 12.8 t-80 -76.73 156.52 32.4 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.795 0.331 . . . . 0.0 110.28 178.547 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.452 ' HA ' ' HA3' ' A' ' 46' ' ' GLY . 2.0 pt-20 -61.89 -26.98 68.48 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.798 0.333 . . . . 0.0 111.3 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -97.68 123.12 41.47 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.106 0.479 . . . . 0.0 111.564 -179.313 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 26.0 ttt -48.35 -49.14 35.51 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.693 179.852 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 -66.32 -38.78 88.47 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.466 -179.211 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.605 HG21 ' ND1' ' A' ' 66' ' ' HIS . 84.7 m -64.53 -41.51 96.33 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.719 -179.889 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.606 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -61.78 -48.7 79.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.646 179.599 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 25.4 mt -60.34 -46.85 94.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 120.891 0.377 . . . . 0.0 110.564 179.647 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -64.16 -39.2 93.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.615 179.558 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -65.46 -47.4 76.27 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.363 179.533 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.467 HD11 ' N ' ' A' ' 51' ' ' ALA . 0.5 OUTLIER -50.75 -57.82 7.42 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 179.204 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.54 HD13 HD12 ' A' ' 80' ' ' LEU . 22.9 mm -56.04 -32.16 32.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 178.482 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -59.94 -27.83 67.12 Favored 'General case' 0 N--CA 1.442 -0.839 0 CA-C-O 121.099 0.476 . . . . 0.0 110.596 178.487 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.99 -26.87 23.57 Favored 'General case' 0 CA--C 1.521 -0.135 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.219 179.27 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.729 ' O ' HD12 ' A' ' 84' ' ' LEU . 57.0 mt -62.87 -51.03 68.57 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 108.004 -1.109 . . . . 0.0 108.004 177.6 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -61.2 -44.83 96.65 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 114.567 -1.197 . . . . 0.0 110.778 177.841 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.51 -38.78 91.26 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.005 -179.356 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' GLN . . . . . 0.435 ' NE2' ' O ' ' A' ' 61' ' ' VAL . 42.5 mt-30 -74.23 -39.15 63.27 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.874 0.369 . . . . 0.0 110.738 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.729 HD12 ' O ' ' A' ' 80' ' ' LEU . 2.9 mt -64.96 -26.88 68.49 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.814 179.599 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 39.6 t30 -62.3 -38.15 88.28 Favored 'General case' 0 CA--C 1.523 -0.09 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.315 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 19.7 mttt . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.975 179.958 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 2' ' ' MET . . . . . 0.471 ' SD ' HD12 ' A' ' 23' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.863 0.364 . . . . 0.0 110.921 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 31.5 t-20 -121.89 119.06 30.49 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.42 -179.52 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 36.4 mt -118.27 123.73 72.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.476 179.363 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -134.67 160.44 38.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.97 0.414 . . . . 0.0 111.281 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 21.6 p -163.92 142.42 7.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.584 -179.67 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 10.6 mttt -100.9 28.49 5.2 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.892 -179.809 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 3.5 tp-100 -141.25 -46.08 0.38 Allowed 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.622 179.692 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 5.4 mpp? -114.0 -176.81 2.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.683 179.764 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -120.52 169.74 10.05 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.518 179.819 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.714 ' CD1' ' N ' ' A' ' 11' ' ' ILE . 0.3 OUTLIER -88.44 101.69 12.01 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.012 0 CA-C-O 121.547 0.689 . . . . 0.0 110.623 -178.474 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 17.6 p -95.55 151.1 38.32 Favored Pre-proline 0 C--N 1.322 -0.606 0 CA-C-N 114.695 -1.139 . . . . 0.0 110.877 179.735 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -54.78 -26.64 48.52 Favored 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 122.438 2.092 . . . . 0.0 111.803 179.182 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -74.48 -44.48 51.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.578 179.406 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.651 ' O ' HG23 ' A' ' 19' ' ' VAL . 21.3 mt -72.18 -27.78 27.66 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.326 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 178.987 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.5 -44.94 33.13 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.549 -0.751 . . . . 0.0 109.728 178.772 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 43.9 tt0 -67.67 -40.46 84.44 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.762 179.114 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.527 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 77.8 t60 -60.62 -58.02 10.23 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 179.167 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.651 HG23 ' O ' ' A' ' 15' ' ' ILE . 25.2 t -60.7 -47.87 91.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.693 0.282 . . . . 0.0 110.32 178.704 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.717 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -59.04 -40.6 85.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.226 -0.443 . . . . 0.0 112.039 179.662 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.527 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 0.9 OUTLIER -59.7 -35.1 73.82 Favored 'General case' 0 C--N 1.332 -0.166 0 C-N-CA 120.512 -0.475 . . . . 0.0 109.887 179.737 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.615 ' O ' HD12 ' A' ' 26' ' ' LEU . 5.6 mmm180 -76.53 -27.36 55.94 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.658 179.567 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.717 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 3.5 mt -68.54 -58.21 4.63 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.083 0.468 . . . . 0.0 110.529 179.687 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.65 -23.73 65.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.314 179.922 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 6.8 tmtt? -79.42 -29.79 42.05 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.132 0.491 . . . . 0.0 110.462 179.541 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.625 HD11 HG21 ' A' ' 77' ' ' ILE . 6.9 mt . . . . . 0 C--N 1.328 -0.354 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.077 -179.802 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.513 ' HB3' HG23 ' A' ' 53' ' ' ILE . 95.3 Cg_endo . . . . . 0 N--CA 1.463 -0.319 0 CA-C-O 120.82 0.259 . . . . 0.0 111.524 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' HIS . . . . . 0.504 ' C ' HD12 ' A' ' 38' ' ' ILE . 1.7 t-160 -107.43 129.79 54.89 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.07 0.462 . . . . 0.0 111.778 -179.261 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.642 HD12 ' N ' ' A' ' 38' ' ' ILE . 3.4 mp -121.09 133.17 68.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.526 179.45 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 5.2 mt -118.89 149.2 21.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.228 -179.78 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 8.9 mt -124.93 126.86 46.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.89 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 34.6 m -123.49 -173.83 2.82 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.507 179.739 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.432 ' HG3' ' CD2' ' A' ' 47' ' ' PHE . 3.4 ttpt -160.48 139.05 10.22 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.306 0.574 . . . . 0.0 111.333 -179.644 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -130.76 156.56 79.71 Favored Pre-proline 0 C--N 1.323 -0.583 0 CA-C-N 115.129 -0.941 . . . . 0.0 109.281 179.146 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_exo -51.34 -24.55 16.11 Favored 'Trans proline' 0 C--O 1.232 0.187 0 C-N-CA 121.974 1.783 . . . . 0.0 112.481 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -89.07 -6.2 57.29 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.456 -0.793 . . . . 0.0 112.662 -179.242 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 149.16 -161.55 28.76 Favored Glycine 0 C--O 1.224 -0.48 0 C-N-CA 120.245 -0.979 . . . . 0.0 112.129 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.432 ' CD2' ' HG3' ' A' ' 42' ' ' LYS . 16.9 m-85 -110.36 154.59 23.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.523 0.678 . . . . 0.0 111.98 179.923 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.528 HG22 ' HG2' ' A' ' 65' ' ' LYS . 68.8 t -128.08 139.34 52.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 114.867 -1.06 . . . . 0.0 110.94 -179.266 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.437 ' O ' ' HA ' ' A' ' 63' ' ' SER . . . -131.27 124.51 30.65 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.761 179.715 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -118.96 147.98 43.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.743 0.306 . . . . 0.0 110.999 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.499 ' N ' HD11 ' A' ' 76' ' ' LEU . . . -144.29 141.42 29.79 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.558 179.886 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.1 m -135.79 130.3 33.83 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.014 179.4 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.638 ' O ' HG13 ' A' ' 59' ' ' VAL . 11.7 mt -130.54 134.19 62.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 120.825 0.345 . . . . 0.0 110.904 -179.54 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -104.24 133.49 49.07 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.68 179.623 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 6.3 p -134.29 135.25 23.7 Favored Pre-proline 0 C--N 1.326 -0.421 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.347 179.476 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_exo -45.87 -20.81 0.81 Allowed 'Trans proline' 0 CA--C 1.53 0.29 0 C-N-CA 122.381 2.054 . . . . 0.0 112.921 179.853 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -111.48 20.69 16.97 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 112.095 0.406 . . . . 0.0 112.095 -179.571 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 142.44 -174.71 23.25 Favored Glycine 0 C--N 1.332 0.342 0 C-N-CA 120.286 -0.959 . . . . 0.0 113.319 179.52 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.638 HG13 ' O ' ' A' ' 53' ' ' ILE . 21.2 t -143.85 139.62 25.35 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-O 120.789 0.328 . . . . 0.0 111.005 -179.936 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.5 mp -117.85 153.76 32.97 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.009 0.433 . . . . 0.0 111.612 -179.418 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 16.7 t -140.49 145.64 25.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.714 179.742 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -153.15 152.57 31.42 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.189 0.519 . . . . 0.0 111.841 -179.579 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' SER . . . . . 0.483 ' HA ' HD12 ' A' ' 76' ' ' LEU . 0.1 OUTLIER -144.89 158.08 43.93 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.666 -179.437 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.615 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -151.55 105.28 0.28 Allowed Glycine 0 C--N 1.331 0.298 0 N-CA-C 111.497 -0.641 . . . . 0.0 111.497 179.341 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.528 ' HG2' HG22 ' A' ' 48' ' ' VAL . 0.3 OUTLIER -106.71 44.83 1.02 Allowed 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.281 0.474 . . . . 0.0 112.281 -178.834 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 16.5 t-80 -75.4 156.36 35.45 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.635 -0.257 . . . . 0.0 110.317 178.601 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -59.61 -28.62 67.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.489 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 9.0 t0 -97.98 119.6 36.9 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.972 0.415 . . . . 0.0 111.566 -179.292 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' MET . . . . . 0.422 ' O ' HD12 ' A' ' 73' ' ' ILE . 3.7 ttt -47.86 -47.01 31.84 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.516 179.846 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 35.5 m-85 -66.45 -42.28 87.82 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.151 -179.521 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 56.7 m -65.33 -37.4 86.98 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.669 179.881 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.615 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -62.4 -50.6 70.88 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.747 179.588 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.483 HG21 HG22 ' A' ' 19' ' ' VAL . 6.7 mt -61.97 -41.3 90.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 179.412 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -64.44 -41.45 96.56 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.062 179.091 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -66.31 -39.43 89.31 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.496 179.367 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.733 HD23 HG13 ' A' ' 77' ' ' ILE . 0.4 OUTLIER -54.97 -63.73 1.06 Allowed 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 179.079 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.733 HG13 HD23 ' A' ' 76' ' ' LEU . 4.8 mt -54.64 -26.89 17.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 110.274 -0.269 . . . . 0.0 110.274 178.871 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.23 -40.22 85.21 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-O 121.48 0.657 . . . . 0.0 109.282 178.087 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 7.3 mmtm -73.94 -31.38 63.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 114.916 -1.038 . . . . 0.0 110.205 178.817 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.79 ' O ' HD12 ' A' ' 84' ' ' LEU . 84.7 mt -62.88 -47.38 83.57 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 107.817 -1.179 . . . . 0.0 107.817 177.593 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -60.73 -46.25 91.14 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 114.821 -1.082 . . . . 0.0 110.32 177.65 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.42 -31.24 72.34 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.741 -179.858 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 -74.81 -45.32 44.29 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.942 0.401 . . . . 0.0 110.436 179.684 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.79 HD12 ' O ' ' A' ' 80' ' ' LEU . 1.4 mt -65.28 -26.17 67.96 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.865 179.681 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -62.71 -31.94 72.95 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.055 0.455 . . . . 0.0 110.357 179.647 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.246 179.888 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 2' ' ' MET . . . . . 0.405 ' HB3' ' CD1' ' A' ' 23' ' ' LEU . 0.1 OUTLIER . . . . . 0 CA--C 1.526 0.04 0 CA-C-O 120.826 0.346 . . . . 0.0 110.694 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -124.45 130.52 52.62 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.297 -179.666 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 39.6 mt -136.2 124.82 37.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.667 179.621 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -134.45 160.74 37.04 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.941 0.401 . . . . 0.0 111.255 -179.962 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.415 ' HB3' ' HB2' ' A' ' 40' ' ' LEU . 21.9 p -162.67 145.75 11.09 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.39 -179.474 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.47 30.05 4.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.404 -179.47 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -142.39 -53.87 0.42 Allowed 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.806 179.579 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 2.1 mpp? -109.23 -176.68 3.09 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.803 179.8 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -115.72 168.74 9.76 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.666 179.754 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.465 HG22 ' HG3' ' A' ' 16' ' ' ARG . 5.1 mm -90.5 114.01 27.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 121.043 0.449 . . . . 0.0 111.143 -179.385 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 13.6 p -99.8 157.72 33.4 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.911 179.632 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -61.7 -15.76 44.21 Favored 'Trans proline' 0 C--N 1.343 0.265 0 C-N-CA 122.482 2.121 . . . . 0.0 111.88 179.056 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -83.15 -41.06 18.94 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-O 121.019 0.438 . . . . 0.0 110.263 179.181 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.45 ' O ' HG23 ' A' ' 19' ' ' VAL . 42.2 mt -72.79 -29.09 28.73 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.285 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 178.801 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.465 ' HG3' HG22 ' A' ' 11' ' ' ILE . 75.9 mtt180 -73.45 -47.33 42.35 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.521 178.667 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -67.15 -38.46 85.54 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.89 179.149 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.491 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 75.5 t60 -59.53 -62.7 1.68 Allowed 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.872 -0.418 . . . . 0.0 109.872 179.17 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.715 HG13 HD11 ' A' ' 77' ' ' ILE . 22.6 t -60.82 -47.57 92.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.735 178.95 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.669 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -56.68 -44.84 81.85 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 111.855 0.317 . . . . 0.0 111.855 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.491 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 1.1 p30 -59.34 -32.97 70.58 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.044 0.449 . . . . 0.0 110.408 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 31.3 mmt180 -75.13 -28.85 60.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.859 179.793 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.681 HD21 HG12 ' A' ' 19' ' ' VAL . 3.5 mt -69.17 -54.43 14.91 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.96 0.41 . . . . 0.0 110.659 179.653 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.51 -25.93 62.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.103 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.3 -32.3 43.48 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.268 0.556 . . . . 0.0 109.875 178.965 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 31.6 mt . . . . . 0 C--N 1.33 -0.256 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.673 179.757 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.484 ' HB3' HG23 ' A' ' 53' ' ' ILE . 95.2 Cg_endo . . . . . 0 N--CA 1.462 -0.35 0 CA-C-O 120.835 0.264 . . . . 0.0 112.241 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 1.7 t-160 -136.68 128.77 29.59 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.918 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.59 HD12 ' N ' ' A' ' 38' ' ' ILE . 3.7 mp -120.61 137.52 54.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.2 179.949 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 4.3 mp -114.7 148.28 17.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.877 179.927 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.415 ' HB2' ' HB3' ' A' ' 6' ' ' SER . 10.0 mt -123.34 127.5 48.59 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.939 0.4 . . . . 0.0 111.018 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -125.06 -170.97 2.26 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.645 179.918 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.471 ' HA ' ' HA ' ' A' ' 47' ' ' PHE . 2.7 ttmm -171.35 145.12 2.09 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.202 0.525 . . . . 0.0 111.039 -179.855 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.46 ' N ' ' HG2' ' A' ' 42' ' ' LYS . 2.2 mm-40 -130.1 166.28 27.64 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.015 178.816 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' PRO . . . . . 0.429 ' HD2' ' HB3' ' A' ' 43' ' ' GLU . 80.1 Cg_exo -48.72 -19.84 2.38 Favored 'Trans proline' 0 N--CA 1.463 -0.28 0 C-N-CA 121.837 1.691 . . . . 0.0 112.622 -178.946 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -85.38 -77.21 0.3 Allowed 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.004 179.078 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' GLY . . . . . 0.463 ' HA3' ' HA ' ' A' ' 67' ' ' GLU . . . -142.37 -153.69 5.97 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.629 -179.409 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.471 ' HA ' ' HA ' ' A' ' 42' ' ' LYS . 21.6 m-85 -109.29 150.5 27.88 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-O 121.709 0.766 . . . . 0.0 112.583 -179.354 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.612 HG22 ' CG ' ' A' ' 65' ' ' LYS . 59.8 t -124.37 140.39 47.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 114.397 -1.274 . . . . 0.0 110.254 179.955 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -131.62 124.98 31.07 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.66 0.267 . . . . 0.0 110.812 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -119.13 148.26 43.26 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.443 179.679 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.564 ' N ' HD11 ' A' ' 76' ' ' LEU . . . -147.11 144.38 28.99 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.981 0.42 . . . . 0.0 112.063 179.84 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.0 m -136.75 129.29 30.26 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.704 179.163 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.669 ' O ' HG13 ' A' ' 59' ' ' VAL . 9.0 mt -131.13 140.93 47.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-O 121.053 0.454 . . . . 0.0 111.716 -179.23 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -100.6 140.86 34.27 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.891 179.321 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 5.9 p -133.8 156.41 79.42 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.002 179.448 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_exo -65.24 -11.04 28.21 Favored 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 122.244 1.962 . . . . 0.0 112.659 -179.572 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 53.3 m-80 -125.92 21.4 7.55 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 111.75 0.278 . . . . 0.0 111.75 -179.605 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 143.95 -166.73 26.97 Favored Glycine 0 C--N 1.331 0.297 0 C-N-CA 120.258 -0.972 . . . . 0.0 113.181 179.627 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.669 HG13 ' O ' ' A' ' 53' ' ' ILE . 16.6 t -140.13 143.63 29.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 120.68 0.276 . . . . 0.0 110.986 -179.921 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.525 HD23 ' HB2' ' A' ' 83' ' ' GLN . 6.5 mp -118.01 152.16 36.05 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.919 0.39 . . . . 0.0 111.447 -179.676 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 19.6 t -140.8 147.31 22.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.881 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.413 ' HB1' ' HB2' ' A' ' 79' ' ' LYS . . . -153.91 156.73 38.06 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.235 0.54 . . . . 0.0 111.637 -179.724 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' SER . . . . . 0.408 ' HA ' HD12 ' A' ' 76' ' ' LEU . 26.5 p -144.4 158.22 43.86 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.738 -179.341 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.75 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -152.91 105.28 0.27 Allowed Glycine 0 C--N 1.334 0.418 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.731 179.638 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.612 ' CG ' HG22 ' A' ' 48' ' ' VAL . 3.0 mptt -107.1 44.93 1.02 Allowed 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -178.905 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.651 ' ND1' HG21 ' A' ' 71' ' ' THR . 12.6 t-80 -76.21 156.46 33.58 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.802 0.335 . . . . 0.0 110.233 178.596 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.463 ' HA ' ' HA3' ' A' ' 46' ' ' GLY . 5.0 mt-10 -61.38 -26.45 67.84 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.781 0.324 . . . . 0.0 111.132 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -98.32 122.13 41.12 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.034 0.445 . . . . 0.0 111.372 -179.48 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' MET . . . . . 0.681 ' HE3' HD11 ' A' ' 73' ' ' ILE . 0.8 OUTLIER -47.93 -49.64 29.5 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.817 179.901 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 18.4 m-85 -65.96 -37.02 84.92 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.587 -179.158 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.651 HG21 ' ND1' ' A' ' 66' ' ' HIS . 97.9 m -64.59 -41.52 96.19 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.695 0.283 . . . . 0.0 110.559 -179.901 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.75 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -61.55 -47.66 84.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.522 179.514 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.681 HD11 ' HE3' ' A' ' 69' ' ' MET . 14.1 mt -60.93 -46.34 96.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.584 179.553 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -64.44 -40.73 96.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.55 179.624 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -65.73 -44.53 85.72 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.604 179.795 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.564 HD11 ' N ' ' A' ' 51' ' ' ALA . 0.3 OUTLIER -53.23 -59.39 4.62 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.368 179.402 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.715 HD11 HG13 ' A' ' 19' ' ' VAL . 44.3 mt -56.12 -29.88 28.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 N-CA-C 110.183 -0.303 . . . . 0.0 110.183 179.023 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.405 ' ND2' ' C ' ' A' ' 78' ' ' ASN . 0.0 OUTLIER -58.72 -38.2 77.83 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.446 0.641 . . . . 0.0 109.668 178.45 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.413 ' HB2' ' HB1' ' A' ' 62' ' ' ALA . 0.0 OUTLIER -73.77 -29.17 62.05 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.01 178.937 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.474 HD12 ' HA ' ' A' ' 77' ' ' ILE . 94.8 mt -62.06 -48.81 78.57 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 107.759 -1.2 . . . . 0.0 107.759 177.379 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 11.9 tt0 -62.68 -44.34 96.51 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 114.514 -1.221 . . . . 0.0 110.481 177.76 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.68 -32.13 73.15 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.028 -179.367 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 83' ' ' GLN . . . . . 0.525 ' HB2' HD23 ' A' ' 60' ' ' LEU . 25.0 mt-30 -74.91 -41.75 59.11 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.123 0.487 . . . . 0.0 110.38 179.788 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.11 -32.15 73.71 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.772 179.682 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 55.9 t30 -61.37 -33.6 73.91 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.549 -178.969 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 21.6 mttm . . . . . 0 C--N 1.326 -0.447 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.335 -179.753 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' MET . . . . . 0.654 ' HG3' HD11 ' A' ' 23' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.528 0.11 0 CA-C-O 120.709 0.29 . . . . 0.0 110.858 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -122.11 120.67 34.94 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.879 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.469 HG23 ' O ' ' A' ' 4' ' ' ILE . 12.5 tt -125.58 124.42 66.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.731 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 3.0 p -134.51 163.73 29.05 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.832 0.348 . . . . 0.0 111.247 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 42.3 p -163.3 131.43 3.72 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.348 -179.5 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 11.7 mttt -100.7 42.39 1.12 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.914 -179.718 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -140.06 -46.14 0.43 Allowed 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.505 179.572 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 10.0 mtm -134.67 -178.87 5.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.468 179.664 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -89.93 164.35 14.6 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.673 179.863 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.0 mm -90.79 116.95 33.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.936 0.398 . . . . 0.0 110.859 -179.669 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 16.0 p -100.6 146.6 32.33 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.091 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_exo -55.33 -21.22 28.36 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.36 2.04 . . . . 0.0 111.652 179.12 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -74.72 -42.33 58.53 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 121.197 0.522 . . . . 0.0 110.287 179.331 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 38.8 mt -72.31 -30.42 35.21 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.305 178.888 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.438 ' O ' ' CB ' ' A' ' 20' ' ' ALA . 7.9 mtt180 -73.2 -46.41 50.6 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.602 178.666 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 47.5 tt0 -66.79 -37.0 83.7 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.641 179.106 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.479 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 50.2 t60 -59.88 -65.28 0.7 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.854 0.359 . . . . 0.0 110.067 179.014 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.646 HG12 HD21 ' A' ' 23' ' ' LEU . 21.6 t -60.18 -46.5 94.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.97 179.168 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.645 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -57.26 -45.34 84.09 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 179.95 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.479 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 1.5 p30 -59.46 -31.56 69.43 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 120.809 -0.356 . . . . 0.0 110.64 -179.857 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 16.6 mmt180 -74.75 -28.6 60.83 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.81 179.726 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.654 HD11 ' HG3' ' A' ' 2' ' ' MET . 1.6 mt -68.32 -51.61 42.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.935 0.398 . . . . 0.0 110.362 179.326 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.29 -24.13 63.02 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.823 179.592 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 7.0 tptp -77.43 -34.05 54.73 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.29 179.339 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.468 HD11 HG22 ' A' ' 77' ' ' ILE . 0.5 OUTLIER . . . . . 0 C--N 1.33 -0.259 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.715 179.37 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.513 ' HB3' HG23 ' A' ' 53' ' ' ILE . 94.8 Cg_endo . . . . . 0 N--CA 1.459 -0.532 0 N-CA-C 111.132 -0.372 . . . . 0.0 111.132 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' HIS . . . . . 0.453 ' C ' HD12 ' A' ' 38' ' ' ILE . 0.7 OUTLIER -105.07 127.36 52.85 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.065 0.46 . . . . 0.0 111.959 -179.01 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.635 HD12 ' N ' ' A' ' 38' ' ' ILE . 3.3 mp -120.16 134.09 64.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.062 179.168 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 39.1 mt -116.27 148.42 19.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.42 -179.635 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.2 mt -123.79 127.53 48.22 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.713 179.72 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -125.54 -170.52 2.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.712 -179.916 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.486 ' HA ' ' HA ' ' A' ' 47' ' ' PHE . 0.0 OUTLIER -171.56 145.43 2.04 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.243 0.544 . . . . 0.0 110.943 -179.833 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.449 ' HB3' ' HD2' ' A' ' 44' ' ' PRO . 2.8 mm-40 -130.38 164.9 38.01 Favored Pre-proline 0 C--N 1.323 -0.581 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.197 179.099 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' PRO . . . . . 0.449 ' HD2' ' HB3' ' A' ' 43' ' ' GLU . 3.2 Cg_endo -46.79 -21.82 1.64 Allowed 'Trans proline' 0 N--CA 1.462 -0.355 0 C-N-CA 122.239 1.959 . . . . 0.0 112.363 -179.282 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 45.5 tp60 -84.27 -78.6 0.23 Allowed 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.769 179.105 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' GLY . . . . . 0.439 ' HA3' ' HA ' ' A' ' 67' ' ' GLU . . . -141.07 -152.72 5.8 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.671 -179.288 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.486 ' HA ' ' HA ' ' A' ' 42' ' ' LYS . 19.6 m-85 -110.37 151.06 27.91 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.731 0.777 . . . . 0.0 112.819 -179.249 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.556 HG22 ' HG2' ' A' ' 65' ' ' LYS . 67.0 t -123.89 140.54 47.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 114.393 -1.276 . . . . 0.0 110.251 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.423 ' O ' ' HA ' ' A' ' 63' ' ' SER . . . -132.18 124.83 29.8 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.642 0.258 . . . . 0.0 111.003 -179.853 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -117.19 147.96 42.03 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.287 179.629 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.661 ' N ' HD11 ' A' ' 76' ' ' LEU . . . -144.97 142.74 30.08 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.998 0.428 . . . . 0.0 111.852 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.0 m -135.02 130.18 35.27 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.848 179.324 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.668 ' O ' HG13 ' A' ' 59' ' ' VAL . 16.1 mt -130.52 137.22 56.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.06 0.457 . . . . 0.0 111.464 -179.352 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -101.94 137.19 40.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.749 179.549 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 6.3 p -132.5 161.2 64.68 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.302 179.576 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_exo -68.12 -9.31 25.37 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.43 2.087 . . . . 0.0 112.582 -179.559 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -117.23 -3.71 11.46 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 111.744 0.275 . . . . 0.0 111.744 -179.773 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 158.33 -166.29 34.15 Favored Glycine 0 C--N 1.331 0.304 0 C-N-CA 120.366 -0.921 . . . . 0.0 112.754 179.959 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.668 HG13 ' O ' ' A' ' 53' ' ' ILE . 21.2 t -134.02 140.87 45.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 120.845 0.355 . . . . 0.0 111.161 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 11.0 mt -115.54 156.91 24.88 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.027 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.412 ' O ' ' NE2' ' A' ' 83' ' ' GLN . 21.1 t -140.31 149.69 21.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.008 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.418 ' O ' HD12 ' A' ' 76' ' ' LEU . . . -154.5 155.56 35.09 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.19 0.519 . . . . 0.0 111.544 -179.799 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' SER . . . . . 0.423 ' HA ' ' O ' ' A' ' 49' ' ' ALA . 0.5 OUTLIER -145.45 158.08 43.9 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.759 -179.277 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.43 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -151.88 109.19 0.41 Allowed Glycine 0 C--N 1.331 0.257 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.628 179.505 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.556 ' HG2' HG22 ' A' ' 48' ' ' VAL . 1.0 OUTLIER -109.24 45.02 1.09 Allowed 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -178.861 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 13.0 t-80 -76.22 156.01 33.95 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.784 0.325 . . . . 0.0 110.367 178.651 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.439 ' HA ' ' HA3' ' A' ' 46' ' ' GLY . 0.3 OUTLIER -61.53 -27.52 68.67 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.723 0.297 . . . . 0.0 111.36 -179.84 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -98.2 121.47 40.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.012 0.434 . . . . 0.0 111.508 -179.39 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -47.95 -50.42 27.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.813 179.865 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 43.0 m-85 -66.85 -44.14 81.79 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.775 -179.016 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 16.8 m -63.96 -42.03 97.39 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.801 0.334 . . . . 0.0 110.883 -179.701 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.43 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -61.5 -47.99 83.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.715 179.611 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.621 HG21 HG22 ' A' ' 19' ' ' VAL . 16.4 mt -58.67 -44.28 89.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.96 0.41 . . . . 0.0 110.44 179.636 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -63.41 -36.11 82.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.362 179.373 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -64.85 -41.67 95.51 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.156 -0.475 . . . . 0.0 109.856 179.182 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.661 HD11 ' N ' ' A' ' 51' ' ' ALA . 0.2 OUTLIER -54.87 -59.9 4.1 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 178.878 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.65 HG13 HD23 ' A' ' 76' ' ' LEU . 6.9 mt -56.25 -30.48 30.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 110.013 -0.365 . . . . 0.0 110.013 178.727 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -59.85 -31.74 70.04 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-O 121.304 0.573 . . . . 0.0 110.157 178.196 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 7.2 mmtt -82.85 -24.87 33.06 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.485 179.162 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.574 HD13 HD11 ' A' ' 53' ' ' ILE . 93.4 mt -64.3 -47.63 78.71 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 107.574 -1.269 . . . . 0.0 107.574 177.111 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.575 ' O ' HD12 ' A' ' 84' ' ' LEU . 3.4 tt0 -59.31 -44.69 92.52 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 114.619 -1.173 . . . . 0.0 110.815 177.972 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -69.25 -37.08 77.76 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.706 -179.591 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 83' ' ' GLN . . . . . 0.412 ' NE2' ' O ' ' A' ' 61' ' ' VAL . 36.6 mt-30 -78.19 -48.55 15.61 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 -178.665 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.967 HD13 ' N ' ' A' ' 85' ' ' ASN . 0.0 OUTLIER -63.7 -14.8 55.54 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 120.672 -0.411 . . . . 0.0 111.082 -179.402 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 85' ' ' ASN . . . . . 0.967 ' N ' HD13 ' A' ' 84' ' ' LEU . 0.2 OUTLIER -67.73 -28.23 67.47 Favored 'General case' 0 N--CA 1.457 -0.099 0 CA-C-O 121.152 0.501 . . . . 0.0 110.1 178.762 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 4.0 mmtm . . . . . 0 C--N 1.331 -0.221 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.323 -179.757 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' MET . . . . . 0.588 ' CE ' ' HB2' ' A' ' 20' ' ' ALA . 1.2 ptt? . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.801 0.334 . . . . 0.0 110.867 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -121.95 128.55 51.63 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.107 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 36.9 mt -129.13 124.31 60.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.718 179.663 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -135.63 161.01 36.73 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.042 0.449 . . . . 0.0 111.397 -179.909 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 21.6 p -163.67 141.02 7.25 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.325 -179.682 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -100.36 27.74 5.5 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.183 -179.396 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -142.38 -45.34 0.33 Allowed 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.791 179.625 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 5.0 mpp? -113.23 -176.23 2.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.66 179.764 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -118.85 165.63 13.8 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.503 179.705 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 5.7 mm -89.73 109.3 20.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 121.149 0.499 . . . . 0.0 111.101 -179.413 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 16.1 p -98.19 159.09 31.54 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 115.428 -0.806 . . . . 0.0 110.986 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.431 ' HA ' ' HG2' ' A' ' 16' ' ' ARG . 23.6 Cg_exo -62.54 -13.5 33.84 Favored 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 122.579 2.186 . . . . 0.0 111.919 179.006 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -86.59 -41.93 13.89 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.959 0.409 . . . . 0.0 110.597 179.483 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 25.5 mt -71.93 -31.52 40.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.844 -0.616 . . . . 0.0 109.587 179.44 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.449 ' O ' ' HE1' ' A' ' 2' ' ' MET . 26.6 ptt180 -72.93 -44.24 61.43 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.485 178.796 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.401 ' N ' ' CG ' ' A' ' 16' ' ' ARG . 1.9 tm0? -65.62 -38.7 90.19 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.635 179.078 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.581 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 78.2 t60 -60.36 -50.05 75.16 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.48 -0.488 . . . . 0.0 109.685 178.787 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.704 ' O ' ' HG3' ' A' ' 22' ' ' ARG . 79.7 t -63.64 -44.01 98.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 177.982 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.684 ' HA ' ' HB2' ' A' ' 23' ' ' LEU . . . -63.24 -37.06 85.76 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.907 -0.317 . . . . 0.0 111.783 179.915 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.581 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 0.8 OUTLIER -60.3 -44.03 95.79 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 -179.611 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.784 ' HD3' HG21 ' A' ' 77' ' ' ILE . 1.6 ppt_? -74.75 -16.63 60.72 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.728 0.775 . . . . 0.0 109.01 178.372 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.684 ' HB2' ' HA ' ' A' ' 20' ' ' ALA . 0.2 OUTLIER -70.2 -63.78 1.02 Allowed 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 114.387 -1.279 . . . . 0.0 109.918 178.858 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.01 -21.14 65.94 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.185 179.338 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.12 -29.81 38.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.993 0.425 . . . . 0.0 110.935 179.789 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.627 HD12 ' HD2' ' A' ' 22' ' ' ARG . 9.1 mt . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.028 -179.582 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo . . . . . 0 N--CA 1.463 -0.298 0 N-CA-C 111.433 -0.257 . . . . 0.0 111.433 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -134.26 133.25 40.6 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.202 0.525 . . . . 0.0 111.907 -179.14 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.443 ' CD1' ' HB1' ' A' ' 51' ' ' ALA . 13.9 mm -121.47 132.21 71.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.64 179.531 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 37.9 mt -119.69 146.74 23.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.98 -179.883 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.647 HD22 HD11 ' A' ' 73' ' ' ILE . 2.2 mt -124.35 126.36 45.87 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.013 0.435 . . . . 0.0 110.842 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -123.02 -173.17 2.65 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.421 179.615 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.412 ' HA ' ' HA ' ' A' ' 47' ' ' PHE . 81.9 tttt -163.55 139.28 6.6 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.386 0.612 . . . . 0.0 111.285 -179.764 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -130.85 158.79 73.95 Favored Pre-proline 0 C--N 1.323 -0.554 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.382 179.137 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_exo -52.05 -24.31 19.4 Favored 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 121.957 1.772 . . . . 0.0 112.489 179.988 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.26 -6.03 57.12 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.506 -0.77 . . . . 0.0 112.689 -179.107 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 148.86 -161.02 28.59 Favored Glycine 0 C--O 1.223 -0.542 0 C-N-CA 120.299 -0.953 . . . . 0.0 112.159 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.423 ' CD1' ' N ' ' A' ' 47' ' ' PHE . 18.0 m-85 -111.35 155.11 23.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.516 0.674 . . . . 0.0 111.989 -179.908 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.781 HG22 ' CG ' ' A' ' 65' ' ' LYS . 94.0 t -127.41 139.44 51.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 114.844 -1.071 . . . . 0.0 111.01 -179.24 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.408 ' O ' ' HA ' ' A' ' 63' ' ' SER . . . -130.65 122.41 27.33 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.447 179.4 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -119.61 147.04 44.98 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.808 0.337 . . . . 0.0 111.115 -179.616 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.637 ' N ' HD11 ' A' ' 76' ' ' LEU . . . -143.56 139.43 29.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.207 179.719 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.0 m -135.95 130.54 33.84 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.294 179.674 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.676 ' O ' HG13 ' A' ' 59' ' ' VAL . 23.4 mt -132.38 134.89 58.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 120.873 0.368 . . . . 0.0 111.215 -179.753 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 9.3 m120 -103.02 119.41 38.8 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.978 179.625 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 33.3 p -112.44 157.09 41.11 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.406 179.541 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -63.3 -14.25 40.89 Favored 'Trans proline' 0 C--N 1.342 0.227 0 C-N-CA 122.521 2.148 . . . . 0.0 112.643 -179.77 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 59.6 m-80 -117.77 24.17 11.23 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.463 -179.707 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 134.93 -167.58 23.98 Favored Glycine 0 C--N 1.331 0.262 0 C-N-CA 120.48 -0.867 . . . . 0.0 112.815 179.797 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.676 HG13 ' O ' ' A' ' 53' ' ' ILE . 14.1 t -138.92 142.47 34.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 120.703 0.287 . . . . 0.0 110.956 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 16.3 mt -116.5 151.21 36.56 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.033 -179.79 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 15.0 p -139.47 148.18 23.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.086 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.536 ' O ' HD12 ' A' ' 76' ' ' LEU . . . -154.5 149.59 26.9 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.132 0.491 . . . . 0.0 111.559 -179.721 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' SER . . . . . 0.408 ' HA ' ' O ' ' A' ' 49' ' ' ALA . 6.3 m -143.99 158.26 43.82 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.662 -179.437 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.658 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -150.48 105.34 0.29 Allowed Glycine 0 C--N 1.332 0.359 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.659 179.456 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.781 ' CG ' HG22 ' A' ' 48' ' ' VAL . 0.2 OUTLIER -103.75 45.04 0.98 Allowed 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.14 0.422 . . . . 0.0 112.14 -178.904 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.461 ' CE1' HG21 ' A' ' 71' ' ' THR . 12.5 t-80 -76.27 155.93 33.91 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.62 -0.264 . . . . 0.0 110.437 178.846 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -60.31 -28.0 67.77 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.587 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 7.2 t0 -98.29 120.13 38.17 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.957 0.408 . . . . 0.0 111.526 -179.308 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 24.2 ttt -48.05 -47.24 33.83 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.608 179.86 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -66.28 -41.21 90.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.101 -179.584 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.461 HG21 ' CE1' ' A' ' 66' ' ' HIS . 76.8 m -65.22 -37.22 86.6 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.416 -0.357 . . . . 0.0 110.613 179.779 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.658 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -63.08 -50.77 69.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.689 179.626 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.647 HD11 HD22 ' A' ' 40' ' ' LEU . 7.8 mt -62.08 -41.98 93.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 179.262 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -63.86 -39.86 95.2 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 178.937 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.439 ' HA ' ' HB3' ' A' ' 78' ' ' ASN . 5.3 mt-10 -66.88 -41.11 87.8 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.39 179.207 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.637 HD11 ' N ' ' A' ' 51' ' ' ALA . 0.2 OUTLIER -53.2 -61.65 2.16 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 178.838 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.784 HG21 ' HD3' ' A' ' 22' ' ' ARG . 52.2 mt -54.96 -30.27 23.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 178.502 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.439 ' HB3' ' HA ' ' A' ' 75' ' ' GLU . 0.0 OUTLIER -57.77 -38.48 75.51 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.065 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.14 -30.92 55.31 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 114.704 -1.135 . . . . 0.0 109.839 178.592 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.799 ' O ' HD12 ' A' ' 84' ' ' LEU . 67.7 mt -64.74 -49.15 71.94 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 107.987 -1.116 . . . . 0.0 107.987 177.608 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -59.71 -48.73 80.52 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.151 177.633 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 50.5 mtt-85 -64.3 -25.57 68.11 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.962 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -74.63 -48.57 25.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.354 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.799 HD12 ' O ' ' A' ' 80' ' ' LEU . 1.0 OUTLIER -64.5 -29.16 70.2 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.497 179.64 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 31.1 t-20 -61.54 -33.29 73.58 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.024 -0.535 . . . . 0.0 109.912 179.719 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.362 179.423 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 2' ' ' MET . . . . . 0.512 ' HG2' ' O ' ' A' ' 2' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.464 0.252 0 CA-C-O 121.444 0.64 . . . . 0.0 111.985 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 3' ' ' ASN . . . . . 0.454 HD21 ' CD2' ' A' ' 37' ' ' HIS . 12.7 t30 -120.02 97.58 5.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.276 -179.58 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.565 ' CG2' HD11 ' A' ' 40' ' ' LEU . 34.3 mt -97.04 124.89 50.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.645 179.455 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -134.44 159.9 39.64 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.953 0.406 . . . . 0.0 111.239 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.609 ' HB3' HD12 ' A' ' 40' ' ' LEU . 21.8 p -163.42 145.29 9.65 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.475 -179.766 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 20.8 mmtp -103.41 -6.04 22.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.576 -179.663 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -99.97 -28.21 13.19 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 120.747 0.308 . . . . 0.0 111.209 -179.848 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 37.9 mtm -140.14 -175.52 4.27 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.071 -179.874 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 -111.06 166.93 10.65 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.653 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 5.2 mm -89.97 108.98 20.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 121.101 0.477 . . . . 0.0 111.066 -179.567 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 17.1 p -97.53 154.66 37.88 Favored Pre-proline 0 C--N 1.326 -0.441 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.002 179.721 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_exo -59.54 -17.92 44.16 Favored 'Trans proline' 0 C--N 1.343 0.281 0 C-N-CA 122.466 2.111 . . . . 0.0 112.029 179.339 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.14 -43.48 17.72 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.883 0.373 . . . . 0.0 110.573 179.629 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.576 ' O ' HG23 ' A' ' 19' ' ' VAL . 27.8 mt -72.6 -27.5 25.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.577 179.086 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 17.4 ttm180 -75.6 -44.77 41.32 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.367 178.732 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -67.84 -39.18 83.87 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.698 179.031 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.523 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 78.2 t60 -60.34 -57.23 13.67 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.843 -0.428 . . . . 0.0 109.843 178.989 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' VAL . . . . . 0.625 HG22 HG21 ' A' ' 73' ' ' ILE . 35.7 t -61.52 -47.68 92.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 120.778 0.323 . . . . 0.0 110.146 178.477 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.713 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -57.98 -42.34 84.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.958 179.755 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.523 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 0.9 OUTLIER -59.54 -35.21 73.77 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.118 0.485 . . . . 0.0 110.053 179.96 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.639 ' O ' HD12 ' A' ' 26' ' ' LEU . 25.5 mmm180 -76.24 -26.64 56.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.541 179.415 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.713 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 4.1 mt -68.09 -56.48 8.69 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.01 0.434 . . . . 0.0 110.298 179.484 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.65 -23.58 64.89 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.366 179.736 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.2 tmtm? -78.31 -30.98 48.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.107 0.479 . . . . 0.0 110.344 179.459 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.776 HD11 HG21 ' A' ' 77' ' ' ILE . 4.8 mt . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.649 179.556 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.567 ' HB3' HG23 ' A' ' 53' ' ' ILE . 90.7 Cg_endo . . . . . 0 C--O 1.232 0.185 0 N-CA-C 113.394 0.498 . . . . 0.0 113.394 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' HIS . . . . . 0.532 ' C ' HD12 ' A' ' 38' ' ' ILE . 0.2 OUTLIER -140.45 126.83 19.98 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.109 179.854 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.678 HD12 ' N ' ' A' ' 38' ' ' ILE . 3.0 mp -118.88 136.54 55.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.393 179.587 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 4.9 mt -121.06 148.64 24.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.566 -179.336 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.609 HD12 ' HB3' ' A' ' 6' ' ' SER . 1.3 mt -124.24 126.8 46.71 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.624 -0.717 . . . . 0.0 110.643 179.583 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 2.8 m -123.93 -174.26 2.94 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.507 179.898 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.412 ' HG3' ' CD2' ' A' ' 47' ' ' PHE . 11.0 tttm -160.95 140.71 10.79 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.424 0.631 . . . . 0.0 111.396 -179.845 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 65.2 mt-10 -131.41 162.15 57.74 Favored Pre-proline 0 C--N 1.322 -0.596 0 CA-C-N 115.026 -0.988 . . . . 0.0 109.305 179.347 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_endo -56.43 -25.7 59.12 Favored 'Trans proline' 0 N--CA 1.464 -0.229 0 C-N-CA 121.967 1.778 . . . . 0.0 111.95 179.621 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.09 -7.81 56.41 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.121 -0.945 . . . . 0.0 112.796 -179.059 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 150.52 -163.81 29.67 Favored Glycine 0 C--O 1.224 -0.522 0 C-N-CA 120.229 -0.986 . . . . 0.0 112.245 179.869 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.412 ' CD2' ' HG3' ' A' ' 42' ' ' LYS . 18.0 m-85 -108.87 154.85 21.54 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.499 0.666 . . . . 0.0 111.796 179.953 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.581 HG22 ' HG2' ' A' ' 65' ' ' LYS . 53.1 t -128.69 139.39 52.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 114.927 -1.033 . . . . 0.0 111.145 -179.27 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -130.42 123.91 30.89 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.525 179.441 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 28.7 m-20 -118.67 146.25 44.84 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.65 -0.25 . . . . 0.0 110.727 -179.845 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.609 ' CB ' HD11 ' A' ' 76' ' ' LEU . . . -145.66 140.64 27.45 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.724 -0.39 . . . . 0.0 111.484 179.8 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.407 HG23 HG22 ' A' ' 61' ' ' VAL . 3.0 m -134.59 128.96 34.23 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 179.102 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.567 HG23 ' HB3' ' A' ' 36' ' ' PRO . 21.4 mt -133.75 139.34 48.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 C-N-CA 120.724 -0.391 . . . . 0.0 111.852 -179.277 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -99.86 145.38 27.83 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.85 179.116 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.416 ' HB ' ' HD2' ' A' ' 56' ' ' PRO . 18.9 p -138.76 158.85 69.35 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.502 179.261 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' PRO . . . . . 0.416 ' HD2' ' HB ' ' A' ' 55' ' ' THR . 60.6 Cg_endo -73.96 -1.41 10.82 Favored 'Trans proline' 0 N--CA 1.463 -0.31 0 C-N-CA 121.772 1.648 . . . . 0.0 112.729 -179.243 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -126.5 2.39 6.91 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.567 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 162.31 -164.8 35.74 Favored Glycine 0 C--N 1.333 0.363 0 C-N-CA 120.405 -0.902 . . . . 0.0 112.925 -179.993 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 21.3 t -132.8 148.16 31.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.802 0.334 . . . . 0.0 111.083 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.417 HD11 HD21 ' A' ' 84' ' ' LEU . 14.1 mt -121.09 136.01 55.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.428 -179.672 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.407 HG22 HG23 ' A' ' 52' ' ' THR . 21.3 t -140.69 137.29 35.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.657 179.657 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.57 ' O ' HD12 ' A' ' 76' ' ' LEU . . . -153.09 155.86 37.6 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.279 0.561 . . . . 0.0 111.892 -179.418 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 88.8 p -143.98 157.41 44.35 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.252 -0.885 . . . . 0.0 111.682 -179.31 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.797 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -150.92 99.64 0.2 Allowed Glycine 0 C--N 1.332 0.323 0 CA-C-N 115.833 -0.622 . . . . 0.0 111.559 179.461 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.581 ' HG2' HG22 ' A' ' 48' ' ' VAL . 59.9 mttt -100.83 44.57 1.01 Allowed 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -178.966 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 12.4 t-80 -75.66 155.31 35.89 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.256 178.709 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -60.46 -26.81 67.06 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.685 0.278 . . . . 0.0 111.29 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -97.09 116.7 29.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.99 0.424 . . . . 0.0 111.329 -179.449 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.7 tmt? -47.57 -46.42 28.01 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.665 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 -66.48 -41.41 89.01 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.31 -179.534 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 35.4 m -65.41 -37.67 87.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.787 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.797 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -61.88 -51.54 67.77 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.822 179.782 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.625 HG21 HG22 ' A' ' 19' ' ' VAL . 7.7 mt -61.64 -42.5 94.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 120.84 0.352 . . . . 0.0 110.319 179.561 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -63.67 -40.2 96.24 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.109 179.253 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -66.47 -42.58 87.32 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.635 179.413 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.609 HD11 ' CB ' ' A' ' 51' ' ' ALA . 0.2 OUTLIER -52.55 -60.94 2.63 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 179.3 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.776 HG21 HD11 ' A' ' 26' ' ' LEU . 21.9 mt -56.66 -30.29 31.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 178.706 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -59.19 -29.06 67.2 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-O 121.272 0.558 . . . . 0.0 109.974 178.069 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.46 ' HB2' ' HB1' ' A' ' 62' ' ' ALA . 1.2 mptt -86.49 -29.32 22.84 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.384 179.184 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.695 ' O ' HD12 ' A' ' 84' ' ' LEU . 84.1 mt -63.14 -49.76 73.09 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 177.671 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -60.04 -46.44 89.51 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 114.926 -1.033 . . . . 0.0 110.416 177.759 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.51 -33.86 75.74 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.317 -179.506 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 83' ' ' GLN . . . . . 0.427 HE22 ' HB2' ' A' ' 62' ' ' ALA . 37.0 mt-30 -74.73 -42.36 58.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.836 0.351 . . . . 0.0 110.451 179.765 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.695 HD12 ' O ' ' A' ' 80' ' ' LEU . 1.5 mt -65.05 -29.26 70.14 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.61 179.523 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -61.81 -49.26 77.05 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.133 0.492 . . . . 0.0 110.256 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.367 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.974 179.519 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 25.9 p . . . . . 0 N--CA 1.487 1.408 0 CA-C-O 120.766 0.317 . . . . 0.0 111.183 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' MET . . . . . 0.698 ' HG3' HD11 ' A' ' 23' ' ' LEU . 8.2 ttp -170.36 102.9 0.27 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.826 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -119.52 122.97 42.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.078 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.421 ' CG2' HD11 ' A' ' 40' ' ' LEU . 36.9 mt -120.68 125.54 74.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.849 179.76 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -134.02 160.71 36.92 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.862 0.363 . . . . 0.0 111.119 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.41 ' HB3' ' HB2' ' A' ' 40' ' ' LEU . 44.8 p -163.43 142.67 8.34 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.637 -179.533 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -102.47 31.25 4.15 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.002 -179.571 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -140.95 -48.0 0.41 Allowed 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.647 179.623 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -119.32 -174.29 2.69 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.638 179.72 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -114.33 167.63 10.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.618 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 5.0 mm -91.2 115.56 30.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.109 0.481 . . . . 0.0 111.085 -179.502 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.419 ' H ' HD12 ' A' ' 15' ' ' ILE . 15.4 p -99.74 149.33 35.83 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.887 179.75 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_exo -56.39 -19.64 29.47 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.335 2.023 . . . . 0.0 111.919 179.216 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -77.75 -41.6 37.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.078 0.466 . . . . 0.0 110.284 179.234 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.428 ' O ' HG23 ' A' ' 19' ' ' VAL . 22.9 mt -73.23 -29.1 27.22 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.367 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.517 178.951 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 13.3 ttp85 -74.12 -45.74 47.02 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.604 -0.726 . . . . 0.0 109.227 178.722 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 33.8 tt0 -67.46 -37.35 82.8 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.503 178.877 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.494 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 72.5 t60 -59.2 -62.49 1.85 Allowed 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 178.872 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.89 HG13 HD11 ' A' ' 77' ' ' ILE . 22.2 t -60.65 -46.56 95.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.609 -0.268 . . . . 0.0 110.536 178.849 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.678 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -57.06 -43.94 82.53 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.846 179.746 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.494 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 1.1 p30 -59.66 -33.34 71.42 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.95 0.405 . . . . 0.0 110.645 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 10.3 mmt180 -74.67 -28.16 60.72 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.058 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.698 HD11 ' HG3' ' A' ' 2' ' ' MET . 2.4 mt -67.53 -52.77 34.94 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.151 0.5 . . . . 0.0 110.293 179.453 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.48 -25.45 66.06 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.217 179.704 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.94 -28.28 43.72 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.934 179.958 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.66 HD12 ' HA ' ' A' ' 23' ' ' LEU . 5.8 mt -76.73 59.68 1.59 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.0 -179.816 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.04 -52.49 16.7 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.859 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.416 ' HG3' ' N ' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -52.25 -26.1 11.02 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.473 0.654 . . . . 0.0 110.917 179.691 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.599 ' CD1' HD23 ' A' ' 26' ' ' LEU . 71.4 m95 -87.9 -25.63 23.15 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.943 -1.026 . . . . 0.0 111.794 -179.359 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.4 114.39 1.64 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.87 179.953 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.528 HG23 ' CD2' ' A' ' 32' ' ' HIS . 15.4 t -159.4 -39.69 0.06 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.331 -179.705 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' HIS . . . . . 0.528 ' CD2' HG23 ' A' ' 31' ' ' THR . 1.0 OUTLIER -143.41 -120.17 0.09 Allowed 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 116.748 -0.206 . . . . 0.0 110.892 179.556 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.971 HD23 HG21 ' A' ' 53' ' ' ILE . 1.9 mp 61.06 116.27 0.02 OUTLIER 'General case' 0 N--CA 1.46 0.071 0 CA-C-O 120.768 0.318 . . . . 0.0 110.542 -179.759 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.406 HD11 ' HG3' ' A' ' 56' ' ' PRO . 3.1 mt -127.06 104.48 12.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.813 0.34 . . . . 0.0 111.538 -179.581 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 61.26 74.46 0.51 Allowed Pre-proline 0 C--N 1.328 -0.349 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.432 179.419 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.825 ' HB3' HD12 ' A' ' 53' ' ' ILE . 77.0 Cg_endo -76.93 155.04 34.02 Favored 'Trans proline' 0 C--N 1.343 0.269 0 C-N-CA 122.63 2.22 . . . . 0.0 111.958 179.487 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -136.84 130.05 31.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.233 -179.66 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.64 HD12 ' N ' ' A' ' 38' ' ' ILE . 3.4 mp -121.46 134.6 64.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.855 179.804 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 4.1 mp -116.95 146.04 21.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.999 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.507 HD21 HG12 ' A' ' 73' ' ' ILE . 1.8 mt -122.31 128.32 50.91 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.054 0.454 . . . . 0.0 111.023 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 5.3 m -123.99 -173.55 2.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.301 179.6 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.425 ' HG3' ' CD2' ' A' ' 47' ' ' PHE . 3.0 tttp -158.58 141.29 14.46 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.372 0.606 . . . . 0.0 111.43 -179.678 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -131.82 156.37 80.2 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-N 115.075 -0.966 . . . . 0.0 109.146 179.232 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_exo -51.73 -24.42 17.92 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 121.881 1.721 . . . . 0.0 112.382 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.72 -6.84 55.66 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.47 -0.786 . . . . 0.0 112.808 -179.148 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 149.68 -164.15 29.44 Favored Glycine 0 C--O 1.224 -0.501 0 C-N-CA 120.153 -1.022 . . . . 0.0 112.161 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.425 ' CD2' ' HG3' ' A' ' 42' ' ' LYS . 18.0 m-85 -108.19 152.63 24.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.544 0.688 . . . . 0.0 112.015 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.695 HG22 ' HG2' ' A' ' 65' ' ' LYS . 53.2 t -127.55 142.01 44.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 114.753 -1.112 . . . . 0.0 110.96 -179.23 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -132.45 124.88 29.45 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.986 179.666 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -117.7 149.5 40.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.436 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.64 ' N ' HD11 ' A' ' 76' ' ' LEU . . . -146.02 142.06 28.26 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.905 0.383 . . . . 0.0 111.798 -179.728 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.728 ' O ' HD13 ' A' ' 53' ' ' ILE . 4.4 m -134.35 134.04 41.33 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.278 179.651 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.971 HG21 HD23 ' A' ' 33' ' ' LEU . 3.4 mm -132.54 133.29 59.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.979 0.418 . . . . 0.0 111.16 -179.69 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 13.5 m-20 -102.98 130.86 50.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.427 179.02 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.415 HG22 ' HA ' ' A' ' 33' ' ' LEU . 7.3 p -128.6 165.74 29.38 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.749 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.406 ' HG3' HD11 ' A' ' 34' ' ' ILE . 12.5 Cg_exo -69.87 -8.98 24.96 Favored 'Trans proline' 0 CA--C 1.529 0.247 0 C-N-CA 122.703 2.269 . . . . 0.0 112.55 -179.871 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 7.8 m120 -123.08 22.91 9.41 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 111.694 0.257 . . . . 0.0 111.694 -179.632 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 132.77 -167.42 23.23 Favored Glycine 0 C--N 1.331 0.255 0 C-N-CA 120.441 -0.885 . . . . 0.0 112.938 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.662 HG13 ' O ' ' A' ' 53' ' ' ILE . 14.9 t -136.43 143.48 35.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.813 0.339 . . . . 0.0 110.943 -179.853 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.754 HD21 HD11 ' A' ' 87' ' ' LEU . 1.9 mt -115.55 155.72 27.05 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.981 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 21.4 t -140.19 148.03 22.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.312 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.439 ' HB1' ' HB2' ' A' ' 79' ' ' LYS . . . -153.73 146.52 24.33 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.045 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -146.16 155.72 42.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.744 -179.442 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.462 ' O ' HG13 ' A' ' 48' ' ' VAL . . . -142.85 154.49 25.34 Favored Glycine 0 N--CA 1.452 -0.277 0 N-CA-C 111.181 -0.768 . . . . 0.0 111.181 179.128 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.695 ' HG2' HG22 ' A' ' 48' ' ' VAL . 19.6 mttt -147.59 42.92 1.08 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 117.239 0.519 . . . . 0.0 112.018 -179.336 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.629 ' ND1' HG21 ' A' ' 71' ' ' THR . 12.8 t-80 -76.06 154.96 35.25 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.303 178.935 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -60.96 -26.14 67.32 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.727 0.299 . . . . 0.0 111.165 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -98.5 121.94 41.07 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.044 0.45 . . . . 0.0 111.433 -179.343 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.9 ttt -48.33 -49.18 35.17 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.802 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 42.2 m-85 -65.75 -37.6 86.83 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.44 -179.242 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.629 HG21 ' ND1' ' A' ' 66' ' ' HIS . 93.6 m -64.85 -40.42 95.14 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.792 0.329 . . . . 0.0 110.613 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.82 -48.28 81.31 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.624 179.552 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.507 HG12 HD21 ' A' ' 40' ' ' LEU . 10.3 mt -60.52 -43.0 93.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.839 0.352 . . . . 0.0 110.181 179.384 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -65.21 -39.65 93.08 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.212 179.099 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -66.64 -45.61 78.46 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.728 179.707 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.64 HD11 ' N ' ' A' ' 51' ' ' ALA . 0.2 OUTLIER -53.42 -61.09 2.52 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.554 -0.294 . . . . 0.0 110.284 179.479 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.89 HD11 HG13 ' A' ' 19' ' ' VAL . 62.4 mt -55.37 -28.19 21.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 C-N-CA 120.899 -0.32 . . . . 0.0 110.201 179.086 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -58.99 -38.0 78.15 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 177.95 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.439 ' HB2' ' HB1' ' A' ' 62' ' ' ALA . 0.0 OUTLIER -73.25 -30.22 63.31 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 114.755 -1.112 . . . . 0.0 109.849 178.69 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 84.1 mt -63.31 -48.63 77.27 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 177.511 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.435 ' HG2' ' CZ2' ' A' ' 29' ' ' TRP . 6.4 tt0 -61.69 -49.44 76.46 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 114.625 -1.171 . . . . 0.0 110.52 177.801 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.07 -27.27 69.28 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.157 -179.77 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -75.38 -44.49 44.57 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.932 0.396 . . . . 0.0 110.686 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.704 ' HA ' HD12 ' A' ' 87' ' ' LEU . 3.5 mt -64.2 -26.46 68.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.71 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -63.6 -41.48 98.32 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.192 179.653 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 17.5 mmtt -74.21 -18.98 60.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.285 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.754 HD11 HD21 ' A' ' 60' ' ' LEU . 20.6 mt -67.99 -38.9 83.22 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.945 0.402 . . . . 0.0 110.443 179.842 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 -78.4 -21.1 49.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.842 179.458 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.408 ' CD2' ' O ' ' A' ' 87' ' ' LEU . 22.9 m-70 55.29 -162.64 0.15 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.019 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -168.71 -42.54 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.835 179.828 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 69.56 -175.31 33.83 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.621 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -109.03 -27.42 9.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.781 0.324 . . . . 0.0 110.972 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . 65.64 125.87 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.109 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -154.21 119.46 5.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.819 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -87.72 -79.43 0.29 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.96 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -179.14 -168.73 0.13 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.089 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -93.24 -31.11 14.86 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.061 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 1.6 m -125.1 -65.39 1.03 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.837 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' SER . . . . . 0.514 ' O ' HG22 ' A' ' 100' ' ' VAL . 29.2 t -176.86 -43.88 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.866 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.514 HG22 ' O ' ' A' ' 99' ' ' SER . 24.2 m 45.63 -172.37 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.674 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -177.32 114.6 0.09 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.86 -179.848 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 29.9 m-20 -149.35 122.15 8.7 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.985 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -175.72 131.99 0.27 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.092 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -141.62 143.13 33.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.897 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 19.7 m-85 -109.64 -29.77 8.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.933 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 8.7 m -56.8 -31.38 35.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.204 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.4 tm-20 -144.1 87.53 1.9 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.837 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -166.31 35.6 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.889 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.445 HG23 ' N ' ' A' ' 110' ' ' GLU . 13.9 m -154.99 -46.08 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.083 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 110' ' ' GLU . . . . . 0.445 ' N ' HG23 ' A' ' 109' ' ' VAL . 4.2 tt0 -59.46 -57.95 10.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.863 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -90.92 -32.39 16.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.857 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 . . . . . 0 C--O 1.25 1.089 0 CA-C-O 118.201 -0.904 . . . . 0.0 110.944 179.977 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.486 1.336 0 CA-C-O 120.757 0.313 . . . . 0.0 111.168 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.7 tmt? 57.25 86.3 0.07 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.906 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.401 ' OD1' ' CE1' ' A' ' 37' ' ' HIS . 3.3 t-20 -127.76 109.38 11.59 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.278 -179.631 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.844 HG22 ' HB ' ' A' ' 38' ' ' ILE . 7.7 pt -118.19 128.66 75.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.702 179.561 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.551 ' HA ' HD11 ' A' ' 11' ' ' ILE . 2.9 p -134.0 165.85 24.07 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.229 -179.771 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.469 ' HB3' HD12 ' A' ' 40' ' ' LEU . 21.7 p -163.51 144.47 9.12 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.24 -179.787 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.77 -2.67 27.66 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.67 -179.54 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -98.85 -29.44 12.96 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 120.705 0.288 . . . . 0.0 111.041 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 34.6 mtm -143.41 178.79 7.51 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.032 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -98.74 163.88 12.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.69 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.632 HG22 ' HG3' ' A' ' 16' ' ' ARG . 5.0 mm -90.67 116.68 32.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.052 0.453 . . . . 0.0 111.05 -179.543 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 15.1 p -100.52 158.47 31.86 Favored Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.959 179.771 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_exo -63.32 -14.65 43.41 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.519 2.146 . . . . 0.0 111.911 179.091 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -84.49 -41.24 16.76 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-O 121.012 0.434 . . . . 0.0 110.434 179.507 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 34.6 mt -72.95 -30.5 32.44 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.299 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.284 178.749 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.674 ' HA ' HD11 ' A' ' 4' ' ' ILE . 47.3 mtp180 -71.67 -47.11 56.45 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.502 178.551 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 19.4 tt0 -67.18 -36.07 80.99 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.557 178.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.457 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 56.6 t60 -60.13 -64.56 0.91 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.951 0.405 . . . . 0.0 110.025 178.933 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.698 HG12 HD21 ' A' ' 23' ' ' LEU . 23.3 t -61.34 -47.1 95.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.9 179.128 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.66 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -56.44 -47.06 79.9 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 111.751 0.278 . . . . 0.0 111.751 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.457 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 3.2 p30 -59.83 -29.1 68.04 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.705 -0.398 . . . . 0.0 110.447 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 17.2 mmm180 -75.7 -29.85 59.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.591 179.41 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.698 HD21 HG12 ' A' ' 19' ' ' VAL . 1.3 mt -68.17 -50.62 53.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.942 0.401 . . . . 0.0 110.272 179.183 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.33 -24.32 63.25 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.803 179.467 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 29.4 tttt -78.1 -32.49 50.58 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.409 179.238 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.713 HD23 ' HE1' ' A' ' 29' ' ' TRP . 0.5 OUTLIER -80.69 56.11 2.56 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.757 179.542 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -111.66 -7.8 14.24 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.496 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.72 -13.74 61.7 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.803 0.335 . . . . 0.0 111.389 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.713 ' HE1' HD23 ' A' ' 26' ' ' LEU . 61.7 m95 -85.04 168.58 14.78 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.145 -179.73 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -96.07 -3.05 45.45 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.332 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.692 HG23 HD11 ' A' ' 33' ' ' LEU . 4.7 t -77.52 128.84 34.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.869 0.366 . . . . 0.0 110.526 179.55 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' HIS . . . . . 0.418 ' C ' HD12 ' A' ' 33' ' ' LEU . 64.5 m-70 -81.9 -39.93 23.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.967 -179.799 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 1.02 HD23 HG21 ' A' ' 53' ' ' ILE . 1.6 mp 62.44 135.5 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.276 -179.711 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.584 HG22 ' ND2' ' A' ' 35' ' ' ASN . 4.8 mt -127.56 106.65 15.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-O 121.403 0.621 . . . . 0.0 112.147 -179.235 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.584 ' ND2' HG22 ' A' ' 34' ' ' ILE . 34.1 m-80 53.87 75.61 0.61 Allowed Pre-proline 0 C--N 1.326 -0.431 0 CA-C-N 114.903 -1.044 . . . . 0.0 112.328 178.88 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.5 ' HB3' HG23 ' A' ' 53' ' ' ILE . 86.3 Cg_endo -79.3 154.43 24.78 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.684 2.256 . . . . 0.0 111.326 178.744 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' HIS . . . . . 0.401 ' CE1' ' OD1' ' A' ' 3' ' ' ASN . 1.6 t-160 -134.0 128.43 34.36 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.123 0.487 . . . . 0.0 111.612 -179.397 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.844 ' HB ' HG22 ' A' ' 4' ' ' ILE . 3.4 mp -120.73 135.63 60.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.594 179.491 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 26.5 mt -115.78 146.44 20.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.937 0.399 . . . . 0.0 111.254 -179.761 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.469 HD12 ' HB3' ' A' ' 6' ' ' SER . 2.9 mt -119.86 128.68 53.89 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.808 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 9.2 m -125.5 -170.46 2.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.733 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.487 ' HA ' ' HA ' ' A' ' 47' ' ' PHE . 3.6 ttpm? -173.29 145.96 1.35 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.186 0.517 . . . . 0.0 110.762 -179.812 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.443 ' HB3' ' HD2' ' A' ' 44' ' ' PRO . 5.5 mt-10 -131.0 170.47 11.15 Favored Pre-proline 0 C--N 1.324 -0.504 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.213 179.043 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' PRO . . . . . 0.443 ' HD2' ' HB3' ' A' ' 43' ' ' GLU . 69.0 Cg_exo -51.62 -19.34 7.31 Favored 'Trans proline' 0 N--CA 1.463 -0.282 0 C-N-CA 121.786 1.658 . . . . 0.0 112.354 -179.332 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.01 -78.71 0.27 Allowed 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.905 179.094 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.404 ' HA3' ' HA ' ' A' ' 67' ' ' GLU . . . -141.16 -154.6 6.24 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.665 -179.281 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.487 ' HA ' ' HA ' ' A' ' 42' ' ' LYS . 20.1 m-85 -109.6 151.33 26.96 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 121.623 0.725 . . . . 0.0 112.726 -179.437 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.657 HG22 ' CG ' ' A' ' 65' ' ' LYS . 54.9 t -124.61 142.93 39.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 114.511 -1.222 . . . . 0.0 110.48 -179.888 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -132.9 126.08 31.33 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.238 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.419 ' O ' HG23 ' A' ' 38' ' ' ILE . 1.6 m-20 -118.92 150.28 40.17 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.583 179.713 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.645 ' HB2' HD21 ' A' ' 76' ' ' LEU . . . -146.8 141.14 26.37 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.845 0.355 . . . . 0.0 111.657 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.2 m -135.79 130.83 34.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.024 179.45 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 1.02 HG21 HD23 ' A' ' 33' ' ' LEU . 13.4 mt -133.02 138.03 52.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 121.102 0.477 . . . . 0.0 111.785 -179.69 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 19.9 m-20 -102.05 119.25 38.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.723 179.362 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 10.6 p -112.23 156.3 42.24 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.453 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -63.48 -14.21 41.02 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 122.484 2.123 . . . . 0.0 112.619 -179.776 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 9.1 m120 -119.69 23.4 11.16 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.628 -0.26 . . . . 0.0 111.538 -179.644 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 137.07 -166.95 24.82 Favored Glycine 0 N--CA 1.453 -0.175 0 C-N-CA 120.488 -0.863 . . . . 0.0 112.902 179.791 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.664 HG13 ' O ' ' A' ' 53' ' ' ILE . 15.0 t -135.91 142.91 37.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.828 0.347 . . . . 0.0 111.037 -179.927 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 37.0 mt -116.98 152.75 33.94 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.11 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.522 ' H ' HE22 ' A' ' 83' ' ' GLN . 21.5 t -139.91 146.78 24.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.067 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -153.58 150.64 28.88 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.074 0.464 . . . . 0.0 111.205 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 94.3 p -145.69 156.17 43.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.73 -179.212 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.422 ' O ' ' HA ' ' A' ' 48' ' ' VAL . . . -144.39 146.91 17.83 Favored Glycine 0 C--N 1.331 0.302 0 N-CA-C 111.06 -0.816 . . . . 0.0 111.06 179.034 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.657 ' CG ' HG22 ' A' ' 48' ' ' VAL . 8.1 mttt -141.21 43.8 1.78 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 117.212 0.506 . . . . 0.0 112.056 -178.946 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.609 ' ND1' HG21 ' A' ' 71' ' ' THR . 12.9 t-80 -76.8 155.3 33.17 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.794 0.33 . . . . 0.0 110.436 178.887 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.404 ' HA ' ' HA3' ' A' ' 46' ' ' GLY . 21.2 mt-10 -61.13 -26.66 67.84 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.323 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -97.93 123.62 42.0 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.027 0.441 . . . . 0.0 111.45 -179.34 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.3 ttt -48.06 -50.15 29.0 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.774 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 72.6 m-85 -66.32 -38.29 87.35 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.672 -179.037 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.609 HG21 ' ND1' ' A' ' 66' ' ' HIS . 87.2 m -64.51 -42.57 95.73 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.698 0.285 . . . . 0.0 110.82 -179.775 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.09 -47.42 86.38 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.516 179.575 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.521 HG21 HG22 ' A' ' 19' ' ' VAL . 13.0 mt -60.13 -45.39 95.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 120.959 0.409 . . . . 0.0 110.311 179.459 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -64.62 -39.0 92.92 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.364 179.475 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -65.24 -43.59 90.9 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.412 179.46 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.645 HD21 ' HB2' ' A' ' 51' ' ' ALA . 0.2 OUTLIER -54.35 -57.34 11.64 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 179.065 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.577 HG13 HD23 ' A' ' 76' ' ' LEU . 8.7 mt -57.53 -30.58 36.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 N-CA-C 110.104 -0.332 . . . . 0.0 110.104 178.944 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -57.97 -37.78 74.82 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.561 0.696 . . . . 0.0 109.38 178.391 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -75.11 -28.9 60.41 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.708 -1.133 . . . . 0.0 109.935 178.873 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.483 HD12 ' HA ' ' A' ' 77' ' ' ILE . 99.3 mt -62.74 -49.45 74.98 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 177.424 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -62.29 -43.87 97.83 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 114.53 -1.214 . . . . 0.0 110.511 177.646 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 1.4 ptt180 -62.4 -34.61 77.07 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.638 -179.809 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.522 HE22 ' H ' ' A' ' 61' ' ' VAL . 34.5 mt-30 -74.52 -39.22 62.51 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.478 179.57 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.491 ' CD2' HG21 ' A' ' 31' ' ' THR . 19.3 mt -65.78 -26.01 67.51 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.846 179.581 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -63.93 -42.39 97.36 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.583 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.457 ' HA ' ' CD2' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -73.92 -22.73 59.58 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.051 179.882 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.816 HD23 ' O ' ' A' ' 87' ' ' LEU . 4.2 tt -70.96 -14.37 62.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.955 -179.597 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.405 ' CG ' ' N ' ' A' ' 89' ' ' HIS . 10.3 pt20 -75.83 -47.34 26.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.067 0.46 . . . . 0.0 111.541 -179.278 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.457 ' CD2' ' HA ' ' A' ' 86' ' ' LYS . 6.6 p80 -87.26 -170.73 3.17 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.128 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.421 ' CB ' ' O ' ' A' ' 89' ' ' HIS . 0.6 OUTLIER 83.6 83.83 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.899 179.811 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 69.04 -169.81 42.19 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.528 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -146.99 125.97 12.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.767 0.318 . . . . 0.0 110.915 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.1 174.67 0.84 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.201 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 17.7 ttm-85 -150.26 -47.8 0.13 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.813 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.44 31.67 3.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.778 179.895 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -72.58 -31.08 64.93 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.228 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -62.79 169.22 3.31 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.184 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 34.2 p -87.82 141.67 28.41 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.929 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 66.5 m -109.93 175.42 5.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.909 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 27.1 m -104.04 -29.62 2.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.132 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.91 176.28 0.32 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.887 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 11.5 p30 -157.27 38.53 0.29 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.8 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.77 -19.79 65.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.359 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 22.8 p30 -53.34 168.97 0.13 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.902 0.382 . . . . 0.0 111.16 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 50.7 p90 -59.44 -178.47 0.06 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.979 -179.878 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 21.5 t -124.54 127.5 72.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.02 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -70.23 136.08 49.61 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.899 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -104.8 159.68 15.6 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.991 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 26.9 m -98.45 31.13 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.117 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -132.76 31.55 3.94 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.917 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -119.84 78.6 1.35 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.892 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 24.0 tt0 . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.268 -0.872 . . . . 0.0 110.921 -179.995 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 3.2 p . . . . . 0 N--CA 1.487 1.409 0 CA-C-O 120.866 0.365 . . . . 0.0 111.229 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' MET . . . . . 0.729 ' HG3' HD11 ' A' ' 23' ' ' LEU . 1.9 tmm? -59.14 118.84 6.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.862 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -121.01 111.13 17.09 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.142 -179.819 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 45.8 mt -110.68 125.6 67.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.848 179.65 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.8 p -134.04 160.58 37.31 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.123 179.786 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.431 ' HB3' ' HB2' ' A' ' 40' ' ' LEU . 39.3 p -163.5 140.54 7.25 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.462 -179.557 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.1 mttp -101.13 33.62 2.8 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.032 -179.615 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -140.62 -50.39 0.45 Allowed 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.53 179.584 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 7.7 mtm -120.6 -174.45 2.81 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.606 179.702 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -111.62 171.84 7.25 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.766 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.8 mm -90.93 112.6 25.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 121.063 0.459 . . . . 0.0 111.054 -179.644 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 15.9 p -98.69 153.05 38.09 Favored Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.886 179.608 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_exo -58.61 -17.1 33.38 Favored 'Trans proline' 0 C--N 1.345 0.342 0 C-N-CA 122.379 2.052 . . . . 0.0 111.879 179.139 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.34 -42.53 20.4 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-O 121.022 0.439 . . . . 0.0 110.44 179.399 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.474 ' O ' HG23 ' A' ' 19' ' ' VAL . 36.1 mt -72.81 -28.34 26.97 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 CA-C-N 115.747 -0.661 . . . . 0.0 109.376 178.946 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 1.8 mmm180 -75.2 -46.27 35.05 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.627 178.795 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 51.9 tp60 -67.72 -38.53 83.73 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.714 179.096 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.491 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 81.2 t60 -60.11 -61.43 2.61 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 179.049 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.61 HG12 HD21 ' A' ' 23' ' ' LEU . 29.7 t -60.75 -47.01 95.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 116.622 -0.263 . . . . 0.0 110.552 178.909 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.678 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -57.52 -42.64 83.21 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 111.753 0.279 . . . . 0.0 111.753 179.702 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.491 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 1.0 OUTLIER -59.96 -33.28 71.71 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 120.64 -0.424 . . . . 0.0 110.287 179.916 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 27.2 mmt180 -75.02 -28.03 60.32 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.056 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.729 HD11 ' HG3' ' A' ' 2' ' ' MET . 3.6 mt -68.85 -54.05 17.92 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.004 0.43 . . . . 0.0 110.408 179.397 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.62 -24.31 63.71 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.813 -0.631 . . . . 0.0 111.188 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -79.5 -30.88 42.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.112 0.482 . . . . 0.0 110.286 179.41 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.558 ' HB3' ' HB2' ' A' ' 29' ' ' TRP . 37.2 mt -79.77 58.43 2.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.793 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -56.27 -75.3 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.519 -179.563 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.442 ' HD2' ' CD2' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -51.44 -27.3 9.87 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.182 0.515 . . . . 0.0 111.308 -179.513 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.639 ' HB3' HD13 ' A' ' 84' ' ' LEU . 13.5 m95 -90.72 36.05 0.9 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.475 -179.922 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.814 ' HA ' HD11 ' A' ' 33' ' ' LEU . 8.0 mt-30 -139.32 59.95 1.59 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.014 0.435 . . . . 0.0 110.355 179.685 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -78.29 90.99 4.37 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.051 -179.684 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 70.5 m-70 62.81 -85.23 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.584 179.647 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 1.047 HD23 HG22 ' A' ' 55' ' ' THR . 0.2 OUTLIER 62.71 143.93 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 -179.318 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.903 HD13 ' O ' ' A' ' 33' ' ' LEU . 1.8 mm -135.5 110.07 11.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 121.604 0.716 . . . . 0.0 112.15 -179.597 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 25.4 m-20 52.76 77.61 0.44 Allowed Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 114.69 -1.141 . . . . 0.0 112.61 178.795 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.593 ' HB3' HG23 ' A' ' 53' ' ' ILE . 89.6 Cg_endo -80.91 130.67 7.62 Favored 'Trans proline' 0 N--CA 1.462 -0.375 0 C-N-CA 122.587 2.191 . . . . 0.0 111.279 178.539 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' HIS . . . . . 0.487 ' O ' HD13 ' A' ' 38' ' ' ILE . 0.5 OUTLIER -109.7 132.46 54.12 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.119 0.485 . . . . 0.0 112.153 -178.904 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.701 HD12 ' CB ' ' A' ' 51' ' ' ALA . 10.8 mm -121.51 133.3 68.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.263 179.232 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.529 ' C ' HD22 ' A' ' 40' ' ' LEU . 3.8 mt -123.77 139.2 51.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 120.981 0.419 . . . . 0.0 111.5 -179.375 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.609 HD11 HG12 ' A' ' 73' ' ' ILE . 3.2 mm? -116.93 128.1 54.88 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.727 179.844 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.2 m -124.2 -175.2 3.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.6 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.436 ' HG3' ' CD2' ' A' ' 47' ' ' PHE . 13.5 tttm -158.4 140.15 13.73 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.365 0.602 . . . . 0.0 111.157 -179.558 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 60.1 mt-10 -131.5 156.11 80.56 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 115.105 -0.952 . . . . 0.0 109.313 179.19 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_exo -51.5 -24.67 17.3 Favored 'Trans proline' 0 N--CA 1.464 -0.24 0 C-N-CA 121.906 1.737 . . . . 0.0 112.435 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -89.61 -6.69 56.01 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.437 -0.801 . . . . 0.0 112.749 -179.122 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 150.36 -163.9 29.64 Favored Glycine 0 C--O 1.225 -0.443 0 C-N-CA 120.227 -0.987 . . . . 0.0 112.275 179.906 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.436 ' CD2' ' HG3' ' A' ' 42' ' ' LYS . 18.9 m-85 -109.07 154.43 22.26 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.559 0.695 . . . . 0.0 111.987 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.555 HG22 ' HG2' ' A' ' 65' ' ' LYS . 68.0 t -127.94 139.57 51.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 114.787 -1.097 . . . . 0.0 110.941 -179.391 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -131.14 124.06 29.89 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.597 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -120.08 147.03 45.36 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.658 0.266 . . . . 0.0 110.986 -179.865 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.701 ' CB ' HD12 ' A' ' 38' ' ' ILE . . . -144.35 140.92 29.39 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.829 0.347 . . . . 0.0 111.387 179.738 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.0 m -136.33 131.3 34.13 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.253 179.469 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.683 HG21 HD22 ' A' ' 33' ' ' LEU . 15.3 mt -132.45 135.59 57.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 120.865 0.364 . . . . 0.0 111.252 -179.604 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -104.11 121.16 42.65 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.648 179.372 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' THR . . . . . 1.047 HG22 HD23 ' A' ' 33' ' ' LEU . 7.6 p -116.29 155.03 48.83 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.622 179.791 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_exo -65.33 -11.92 32.44 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.515 2.143 . . . . 0.0 112.528 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 8.5 m-80 -112.37 -4.3 14.31 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 111.732 0.271 . . . . 0.0 111.732 -179.697 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 162.32 -166.98 36.72 Favored Glycine 0 C--N 1.331 0.27 0 C-N-CA 120.388 -0.91 . . . . 0.0 112.82 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 34.8 t -129.98 140.36 49.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 120.835 0.35 . . . . 0.0 111.134 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -118.34 142.58 47.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.818 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.435 ' O ' ' NE2' ' A' ' 83' ' ' GLN . 11.1 p -140.67 146.61 23.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.935 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.513 ' O ' HD12 ' A' ' 76' ' ' LEU . . . -155.85 152.68 28.66 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.265 0.555 . . . . 0.0 111.698 -179.798 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 67.1 m -143.23 160.46 40.43 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.709 -179.347 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.7 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -155.18 105.77 0.28 Allowed Glycine 0 CA--C 1.519 0.289 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.566 179.548 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.555 ' HG2' HG22 ' A' ' 48' ' ' VAL . 1.1 mtmp? -107.73 44.47 1.09 Allowed 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.1 0.408 . . . . 0.0 112.1 -178.812 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 14.6 t-80 -75.72 156.33 34.78 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.578 -0.283 . . . . 0.0 110.415 178.598 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -60.07 -27.28 66.84 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.673 0.273 . . . . 0.0 111.199 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -98.33 120.46 38.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.944 0.402 . . . . 0.0 111.475 -179.438 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.439 ' O ' HD12 ' A' ' 73' ' ' ILE . 13.3 ttt -48.2 -46.72 35.4 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.591 179.813 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 44.3 m-85 -66.47 -40.97 89.63 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.293 -179.418 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 86.8 m -65.26 -38.68 91.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.746 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.7 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -62.13 -50.71 70.8 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.8 179.607 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.609 HG12 HD11 ' A' ' 40' ' ' LEU . 7.0 mt -61.53 -43.78 97.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.788 0.327 . . . . 0.0 110.352 179.543 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -63.52 -40.25 96.55 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.246 179.339 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.12 -42.68 88.84 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.381 179.367 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.565 HD11 ' N ' ' A' ' 51' ' ' ALA . 0.2 OUTLIER -52.19 -62.0 1.91 Allowed 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 109.881 -0.415 . . . . 0.0 109.881 179.036 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 46.3 mt -55.05 -30.29 23.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 178.71 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -59.55 -29.58 68.02 Favored 'General case' 0 N--CA 1.442 -0.856 0 CA-C-O 121.22 0.533 . . . . 0.0 110.298 178.188 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.98 -28.34 22.73 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.354 179.155 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.786 ' O ' HD12 ' A' ' 84' ' ' LEU . 97.3 mt -63.7 -50.31 69.69 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 177.737 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -60.0 -50.67 72.83 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 114.907 -1.042 . . . . 0.0 111.057 177.934 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.52 -32.63 73.6 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.898 -179.349 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.435 ' NE2' ' O ' ' A' ' 61' ' ' VAL . 41.4 mt-30 -74.2 -42.54 59.63 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.619 179.926 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.786 HD12 ' O ' ' A' ' 80' ' ' LEU . 1.6 mt -65.55 -29.2 69.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.462 179.464 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -63.25 -28.25 69.9 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.568 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 25.9 mmtt -72.38 -17.52 61.81 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.249 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 61.3 mt -69.64 -16.68 63.42 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.327 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 -76.26 -22.9 54.58 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.906 0.384 . . . . 0.0 111.272 -179.755 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 9.0 m80 -85.79 -38.69 17.91 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.764 179.82 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.96 -21.05 63.29 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.125 -179.768 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -77.77 59.21 3.82 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.589 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -122.11 -38.83 2.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.941 0.401 . . . . 0.0 110.9 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -131.74 -59.35 0.95 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.0 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 4.7 ttp180 62.78 124.55 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.982 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 10.2 mtp180 -159.36 -46.3 0.05 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.902 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . 59.53 77.72 0.3 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.058 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -110.47 108.14 18.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.088 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 25.6 p -109.33 164.06 12.82 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.883 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.5 m -62.5 178.84 0.38 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.827 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 23.0 m -116.27 145.16 22.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.143 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -112.59 123.91 51.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.937 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -177.88 75.5 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.854 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -160.65 137.81 9.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.167 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 62.73 17.22 9.63 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.351 179.898 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 1.7 t80 48.08 94.5 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.829 0.347 . . . . 0.0 111.29 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 27.4 t -71.99 107.16 2.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.004 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -139.76 138.69 36.12 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.801 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 59.22 91.55 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.926 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 15.3 m -143.61 128.15 14.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.141 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -99.39 72.74 1.83 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.807 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 14.9 tt0 -163.84 113.36 1.25 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.896 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 . . . . . 0 C--O 1.248 1.006 0 CA-C-O 118.239 -0.886 . . . . 0.0 110.96 -179.983 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 11.6 t . . . . . 0 N--CA 1.487 1.377 0 CA-C-O 120.714 0.292 . . . . 0.0 111.307 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' MET . . . . . 0.584 ' HG2' HD11 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -103.9 -177.97 3.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.978 179.984 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -122.38 112.98 18.75 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.392 -179.7 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.468 HG22 ' CD1' ' A' ' 11' ' ' ILE . 34.8 mt -109.97 126.75 67.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.539 179.419 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -134.38 162.25 32.75 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.862 0.363 . . . . 0.0 111.133 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 38.9 p -164.36 136.27 4.63 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.548 -179.739 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.6 mtpp -102.33 18.68 20.4 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.195 -179.737 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.459 ' NE2' ' O ' ' A' ' 42' ' ' LYS . 28.2 mt-30 -141.72 20.61 2.17 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 120.881 0.372 . . . . 0.0 110.927 179.465 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 177.31 -177.99 0.18 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.545 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -117.84 160.22 21.77 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.855 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.468 ' CD1' HG22 ' A' ' 4' ' ' ILE . 3.4 mm -92.28 118.54 38.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.012 -179.746 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.492 ' H ' HD12 ' A' ' 15' ' ' ILE . 13.7 p -100.11 149.87 36.39 Favored Pre-proline 0 C--N 1.326 -0.424 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.701 179.528 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -56.23 -18.99 25.84 Favored 'Trans proline' 0 C--N 1.343 0.288 0 C-N-CA 122.4 2.067 . . . . 0.0 112.131 179.405 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.78 -39.93 25.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.069 0.461 . . . . 0.0 110.443 179.485 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.492 HD12 ' H ' ' A' ' 12' ' ' THR . 21.5 mt -72.93 -31.69 36.86 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.216 178.926 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.422 ' O ' ' CB ' ' A' ' 20' ' ' ALA . 0.2 OUTLIER -72.14 -47.37 51.49 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.537 178.854 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -66.94 -35.6 80.35 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.535 178.95 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.428 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 79.4 t60 -58.65 -65.27 0.69 Allowed 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 178.831 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.955 HG13 HD11 ' A' ' 77' ' ' ILE . 20.3 t -61.2 -46.17 97.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.819 178.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.616 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -55.37 -49.85 71.23 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 111.782 0.29 . . . . 0.0 111.782 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.428 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 3.2 p30 -58.58 -29.16 66.21 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.815 0.34 . . . . 0.0 110.709 -179.709 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.572 ' O ' HD12 ' A' ' 26' ' ' LEU . 41.9 mmt180 -75.14 -28.66 60.24 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.575 179.337 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.702 HD21 HG12 ' A' ' 19' ' ' VAL . 1.1 mt -69.41 -49.6 53.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.985 0.421 . . . . 0.0 110.529 179.148 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.35 -28.03 66.47 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.168 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.1 ttmm -79.53 -32.73 42.3 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.96 0.41 . . . . 0.0 110.587 179.356 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.579 HD23 ' CD1' ' A' ' 29' ' ' TRP . 5.4 mt -81.0 57.36 3.07 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.782 179.814 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -64.4 -63.73 1.06 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.2 -179.715 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.436 ' HD2' ' CZ3' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -48.31 -27.4 2.51 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.395 0.617 . . . . 0.0 111.068 179.997 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.924 ' HB3' HD13 ' A' ' 84' ' ' LEU . 53.9 m95 -86.0 -35.81 20.15 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 114.961 -1.018 . . . . 0.0 111.938 -179.258 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.423 ' O ' ' N ' ' A' ' 32' ' ' HIS . 0.0 OUTLIER -55.21 -56.65 17.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.831 0.348 . . . . 0.0 110.565 179.805 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.461 HG22 ' O ' ' A' ' 29' ' ' TRP . 0.0 OUTLIER 38.78 -90.56 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.769 -0.65 . . . . 0.0 112.044 179.738 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 32' ' ' HIS . . . . . 0.423 ' N ' ' O ' ' A' ' 30' ' ' GLN . 35.2 m-70 -129.38 117.63 20.9 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.047 0.451 . . . . 0.0 111.467 -179.589 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.985 HD22 HG21 ' A' ' 53' ' ' ILE . 24.3 mt -147.05 147.91 31.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.923 179.319 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.602 HD12 ' C ' ' A' ' 33' ' ' LEU . 4.1 mp -144.87 119.16 3.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-O 121.683 0.754 . . . . 0.0 112.177 -179.511 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 11.9 m120 70.69 55.23 0.44 Allowed Pre-proline 0 C--N 1.327 -0.412 0 CA-C-N 114.502 -1.226 . . . . 0.0 111.938 178.892 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -65.09 129.26 22.55 Favored 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 122.186 1.924 . . . . 0.0 111.947 -179.836 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -139.44 127.7 22.65 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.934 0.397 . . . . 0.0 111.687 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.645 HD12 ' N ' ' A' ' 38' ' ' ILE . 3.3 mp -120.86 136.57 57.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.627 179.573 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 23.1 mt -116.91 146.13 21.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.075 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.3 mt -123.26 128.18 49.62 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.759 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 20.1 m -125.21 -172.45 2.59 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.388 179.77 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.459 ' O ' ' NE2' ' A' ' 8' ' ' GLN . 0.0 OUTLIER -162.55 145.28 11.05 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.367 0.603 . . . . 0.0 111.249 -179.878 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -133.57 169.89 12.78 Favored Pre-proline 0 C--N 1.322 -0.624 0 CA-C-N 115.052 -0.976 . . . . 0.0 109.322 179.339 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -61.71 -25.81 79.22 Favored 'Trans proline' 0 N--CA 1.464 -0.253 0 C-N-CA 121.91 1.74 . . . . 0.0 112.088 179.633 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -90.45 -8.39 50.65 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.273 -0.876 . . . . 0.0 113.044 -178.895 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 152.47 -169.06 31.62 Favored Glycine 0 C--O 1.225 -0.46 0 C-N-CA 120.065 -1.064 . . . . 0.0 112.515 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.448 ' CE2' ' HG3' ' A' ' 42' ' ' LYS . 10.7 m-85 -106.02 153.95 21.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.597 0.713 . . . . 0.0 112.162 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.597 HG22 ' HG2' ' A' ' 65' ' ' LYS . 54.3 t -127.58 141.39 46.5 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 CA-C-N 114.665 -1.152 . . . . 0.0 110.97 -179.322 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.444 ' O ' ' HA ' ' A' ' 63' ' ' SER . . . -133.05 123.2 25.34 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.549 179.642 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -119.56 150.77 39.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.648 0.261 . . . . 0.0 110.854 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.558 ' N ' HD11 ' A' ' 76' ' ' LEU . . . -147.44 139.73 24.51 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.75 0.309 . . . . 0.0 111.151 179.589 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 4.5 m -135.14 133.27 39.01 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.328 -0.397 . . . . 0.0 110.171 179.583 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.985 HG21 HD22 ' A' ' 33' ' ' LEU . 18.5 mt -134.52 135.6 53.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.039 0.447 . . . . 0.0 111.387 -179.731 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -104.28 119.66 39.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.458 179.137 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.854 HG22 HD23 ' A' ' 33' ' ' LEU . 7.2 p -112.51 167.07 9.73 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.975 -179.906 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_exo -71.37 -7.84 22.13 Favored 'Trans proline' 0 C--N 1.343 0.279 0 C-N-CA 122.899 2.4 . . . . 0.0 112.636 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -120.19 -4.41 10.0 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 111.776 0.287 . . . . 0.0 111.776 -179.589 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 160.61 -169.76 36.41 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.44 -0.886 . . . . 0.0 112.74 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.573 HG13 ' O ' ' A' ' 53' ' ' ILE . 15.9 t -130.07 143.3 41.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.781 0.324 . . . . 0.0 111.119 -179.944 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.4 mt -118.35 151.37 37.86 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.044 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.4 ' O ' ' NE2' ' A' ' 83' ' ' GLN . 21.4 t -140.57 143.55 28.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.887 179.882 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.445 ' O ' HD12 ' A' ' 76' ' ' LEU . . . -150.95 151.7 32.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.037 0.446 . . . . 0.0 111.603 -179.767 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' SER . . . . . 0.444 ' HA ' ' O ' ' A' ' 49' ' ' ALA . 2.0 t -145.09 155.74 43.51 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.722 -179.423 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.786 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -149.73 102.07 0.23 Allowed Glycine 0 C--N 1.331 0.279 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.609 179.413 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.597 ' HG2' HG22 ' A' ' 48' ' ' VAL . 5.5 mtmp? -103.84 44.55 1.01 Allowed 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -178.804 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.561 ' ND1' HG21 ' A' ' 71' ' ' THR . 12.2 t-80 -75.55 155.64 35.83 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 110.131 -0.322 . . . . 0.0 110.131 178.426 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -60.95 -26.73 67.74 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.731 0.3 . . . . 0.0 111.425 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -97.29 122.17 40.02 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.024 0.44 . . . . 0.0 111.426 -179.314 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 2.5 ttt -47.98 -51.01 25.47 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.891 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 15.9 m-85 -65.89 -37.6 86.55 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.567 -179.122 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.561 HG21 ' ND1' ' A' ' 66' ' ' HIS . 87.5 m -64.7 -41.16 96.21 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.791 0.329 . . . . 0.0 110.649 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.786 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -61.48 -48.2 82.21 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.439 179.607 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.418 ' CG2' HG22 ' A' ' 19' ' ' VAL . 15.7 mt -60.3 -45.47 96.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.869 0.366 . . . . 0.0 110.387 179.635 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -64.29 -39.6 94.25 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.5 179.449 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -65.28 -45.07 85.97 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.449 179.622 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.558 HD11 ' N ' ' A' ' 51' ' ' ALA . 0.3 OUTLIER -52.57 -58.2 7.53 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 179.129 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.955 HD11 HG13 ' A' ' 19' ' ' VAL . 34.7 mt -57.2 -32.45 40.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 178.82 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -59.0 -28.61 66.54 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-O 121.148 0.499 . . . . 0.0 110.174 178.434 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.17 -26.84 24.92 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.118 179.151 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.735 HD12 ' HA ' ' A' ' 77' ' ' ILE . 64.9 mt -62.86 -50.01 72.62 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 107.931 -1.137 . . . . 0.0 107.931 177.424 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.442 ' HG3' ' CD1' ' A' ' 29' ' ' TRP . 5.8 tt0 -60.87 -44.67 96.75 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 114.598 -1.183 . . . . 0.0 110.571 177.711 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 1.1 ptt180 -62.85 -37.59 87.46 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.165 -179.557 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.4 ' NE2' ' O ' ' A' ' 61' ' ' VAL . 35.3 mt-30 -74.28 -40.52 62.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.68 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.924 HD13 ' HB3' ' A' ' 29' ' ' TRP . 3.3 mt -64.79 -24.25 67.49 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.682 179.657 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 17.8 t-20 -62.47 -27.73 69.33 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.42 179.592 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 8.0 mmtt -72.92 -18.42 61.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.205 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.407 HD12 ' HA ' ' A' ' 84' ' ' LEU . 18.7 mt -68.79 -52.71 27.35 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.893 0.378 . . . . 0.0 110.551 179.814 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -77.03 -12.51 59.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.042 179.617 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.411 ' O ' ' CB ' ' A' ' 90' ' ' LYS . 2.2 m80 66.61 -71.37 0.09 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.086 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.411 ' CB ' ' O ' ' A' ' 89' ' ' HIS . 0.0 OUTLIER 80.58 30.27 0.2 Allowed 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.835 179.991 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 166.52 78.5 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.522 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.661 ' HG3' ' HB2' ' A' ' 96' ' ' ALA . 6.9 pt-20 -117.58 170.52 8.69 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.832 0.348 . . . . 0.0 110.938 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -144.15 -65.07 0.36 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.114 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.03 -37.2 85.28 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.924 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 4.3 ttm180 -68.21 -45.81 72.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.909 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.661 ' HB2' ' HG3' ' A' ' 92' ' ' GLU . . . -61.29 160.2 11.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.11 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -154.58 36.4 0.41 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.141 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -131.83 -48.79 0.95 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.892 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 48.2 p -143.03 133.69 25.14 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.895 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 8.9 p -107.61 -26.28 3.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.233 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.73 98.12 6.87 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.927 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -143.98 -57.13 0.38 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.877 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -121.09 -68.93 0.87 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.027 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 45.2 m-20 62.53 -80.74 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.103 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 64.23 -79.06 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.974 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.439 HG23 ' N ' ' A' ' 107' ' ' GLU . 15.4 m -138.32 -45.36 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.142 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' GLU . . . . . 0.439 ' N ' HG23 ' A' ' 106' ' ' VAL . 17.1 mt-10 63.06 94.26 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.837 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 29.2 mm-40 -88.64 99.99 12.75 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.936 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 10.6 p -163.0 137.9 1.38 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.03 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -138.58 77.2 1.61 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.962 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -105.09 -31.33 9.22 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.841 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 13.6 tt0 . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.208 -0.901 . . . . 0.0 110.89 -179.995 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 3.7 t . . . . . 0 N--CA 1.486 1.346 0 CA-C-O 120.78 0.324 . . . . 0.0 111.212 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.29 137.29 36.58 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.841 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -120.78 98.8 6.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.15 -179.729 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.493 ' CG2' HD11 ' A' ' 40' ' ' LEU . 34.2 mt -102.63 124.16 56.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.643 179.586 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.8 p -134.25 159.58 40.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.987 0.422 . . . . 0.0 111.097 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 21.5 p -163.86 143.8 8.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.668 -179.758 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.6 mtmp? -102.51 35.89 2.32 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.035 -179.772 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -141.11 -47.63 0.4 Allowed 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.777 179.718 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 14.3 mtm -126.22 176.44 7.07 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.691 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -99.79 173.96 6.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.828 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 6.0 mm -91.77 110.76 23.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 121.097 0.475 . . . . 0.0 111.075 -179.677 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 13.2 p -97.52 149.5 35.78 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.146 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_exo -55.84 -20.59 29.51 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.423 2.082 . . . . 0.0 111.746 179.06 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -76.15 -43.92 40.67 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.046 0.45 . . . . 0.0 110.339 179.242 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.653 ' O ' HG23 ' A' ' 19' ' ' VAL . 32.2 mt -72.34 -27.85 27.37 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.283 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.58 179.118 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 29.4 ttt-85 -77.45 -43.68 31.6 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.714 -0.676 . . . . 0.0 109.531 178.809 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 34.3 tt0 -67.64 -40.69 84.58 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.638 179.067 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.529 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 79.5 t60 -60.99 -57.32 13.13 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.711 -0.395 . . . . 0.0 109.964 179.167 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.738 HG13 HD11 ' A' ' 77' ' ' ILE . 26.9 t -60.35 -47.81 90.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 178.675 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.707 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -59.72 -40.12 86.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.208 -0.451 . . . . 0.0 112.087 179.793 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.529 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 0.9 OUTLIER -59.59 -35.33 74.09 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 120.497 -0.481 . . . . 0.0 109.999 179.918 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.913 ' O ' HD12 ' A' ' 26' ' ' LEU . 0.5 OUTLIER -76.42 -27.21 56.18 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.775 179.557 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.707 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 5.3 mt -66.48 -56.03 12.82 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.046 0.45 . . . . 0.0 110.225 179.509 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.26 -21.62 64.08 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.162 179.555 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 6.0 tmtm? -79.24 -29.3 42.63 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.686 179.61 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.913 HD12 ' O ' ' A' ' 22' ' ' ARG . 0.4 OUTLIER -78.31 61.15 2.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.666 -179.991 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.36 -52.08 66.75 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.751 -0.658 . . . . 0.0 111.869 -179.448 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.465 ' HG2' ' NE1' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -86.46 28.05 0.89 Allowed 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 120.853 0.359 . . . . 0.0 111.466 -179.595 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.672 ' HB3' HD13 ' A' ' 84' ' ' LEU . 10.0 m95 -149.62 161.98 41.11 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.361 -179.527 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.611 ' HG3' HD11 ' A' ' 33' ' ' LEU . 1.0 OUTLIER 61.19 27.2 16.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.454 -179.284 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 8.8 t -79.99 -23.11 41.8 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.521 -179.661 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' HIS . . . . . 0.669 ' O ' HD23 ' A' ' 33' ' ' LEU . 2.1 p80 -123.27 69.43 1.01 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.999 0.428 . . . . 0.0 111.01 -179.823 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.728 HD22 HG21 ' A' ' 53' ' ' ILE . 23.4 mt -129.1 154.73 46.41 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.334 179.702 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.584 HD12 ' O ' ' A' ' 54' ' ' ASN . 3.5 mp -139.49 100.06 1.3 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.809 0.338 . . . . 0.0 111.479 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 12.9 m120 61.81 71.72 0.72 Allowed Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.372 179.643 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -75.17 151.73 39.12 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.532 2.154 . . . . 0.0 111.844 179.485 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -138.61 126.52 22.42 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.945 0.402 . . . . 0.0 111.521 -179.647 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.64 HD12 ' N ' ' A' ' 38' ' ' ILE . 3.4 mp -118.88 135.71 58.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.626 179.521 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 5.3 mt -116.73 147.08 20.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.227 -179.755 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.493 HD11 ' CG2' ' A' ' 4' ' ' ILE . 3.3 mt -121.9 127.23 50.21 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.696 179.785 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -124.1 -172.42 2.54 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.482 179.913 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.426 ' HG3' ' CD2' ' A' ' 47' ' ' PHE . 1.5 ttpt -161.52 139.52 9.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.299 0.571 . . . . 0.0 111.274 -179.686 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -130.81 157.54 77.55 Favored Pre-proline 0 C--N 1.323 -0.553 0 CA-C-N 115.189 -0.914 . . . . 0.0 109.306 179.159 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 70.9 Cg_exo -51.48 -24.63 17.1 Favored 'Trans proline' 0 N--CA 1.464 -0.215 0 C-N-CA 122.012 1.808 . . . . 0.0 112.464 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.5 tt0 -89.2 -6.08 57.18 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.479 -0.782 . . . . 0.0 112.659 -179.14 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 148.86 -160.91 28.56 Favored Glycine 0 C--O 1.224 -0.511 0 C-N-CA 120.289 -0.957 . . . . 0.0 112.224 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.456 ' CD1' ' N ' ' A' ' 47' ' ' PHE . 13.6 m-85 -110.17 154.74 22.91 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.574 0.702 . . . . 0.0 112.096 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.698 HG22 ' HG3' ' A' ' 65' ' ' LYS . 93.7 t -127.22 140.0 50.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 114.691 -1.141 . . . . 0.0 111.036 -179.012 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -131.49 122.19 25.76 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.41 179.402 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -120.3 149.32 42.49 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.691 0.281 . . . . 0.0 111.071 -179.639 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.579 ' N ' HD11 ' A' ' 76' ' ' LEU . . . -146.55 140.04 25.84 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.815 0.341 . . . . 0.0 111.32 179.535 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.0 m -134.33 131.86 38.83 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.031 179.484 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.728 HG21 HD22 ' A' ' 33' ' ' LEU . 21.9 mt -132.25 136.22 56.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 121.043 0.449 . . . . 0.0 111.676 -179.427 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.584 ' O ' HD12 ' A' ' 34' ' ' ILE . 8.3 m120 -100.97 120.74 40.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.596 179.142 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.497 ' HB ' ' HD2' ' A' ' 56' ' ' PRO . 5.5 p -113.46 173.4 2.89 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.244 179.862 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.497 ' HD2' ' HB ' ' A' ' 55' ' ' THR . 86.5 Cg_endo -86.98 1.67 7.29 Favored 'Trans proline' 0 N--CA 1.457 -0.642 0 C-N-CA 122.353 2.036 . . . . 0.0 112.632 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 5.0 m120 -131.58 20.95 4.68 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.315 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 139.99 -167.57 25.35 Favored Glycine 0 C--N 1.331 0.265 0 C-N-CA 120.603 -0.808 . . . . 0.0 112.646 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 19.0 t -128.68 144.12 39.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.757 0.313 . . . . 0.0 111.178 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 16.7 mt -118.33 144.4 45.89 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.026 -179.847 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 21.6 t -140.26 144.69 27.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.147 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.436 ' O ' HD12 ' A' ' 76' ' ' LEU . . . -153.37 149.77 28.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.063 0.459 . . . . 0.0 111.419 -179.805 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' SER . . . . . 0.417 ' HA ' HD12 ' A' ' 76' ' ' LEU . 56.0 p -145.08 159.93 42.19 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.866 -179.239 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.608 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -150.96 107.33 0.34 Allowed Glycine 0 C--N 1.333 0.371 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.713 179.408 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.698 ' HG3' HG22 ' A' ' 48' ' ' VAL . 0.7 OUTLIER -105.25 43.99 1.07 Allowed 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.062 0.393 . . . . 0.0 112.062 -178.813 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.445 ' CE1' HG21 ' A' ' 71' ' ' THR . 13.0 t-80 -77.45 155.51 31.71 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.713 0.292 . . . . 0.0 110.561 179.2 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -61.08 -26.91 67.98 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.337 179.88 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -98.68 118.99 36.65 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.983 0.42 . . . . 0.0 111.401 -179.313 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.8 tmt? -48.01 -45.77 32.21 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.547 179.829 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 34.4 m-85 -66.52 -41.05 89.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.222 -179.483 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.445 HG21 ' CE1' ' A' ' 66' ' ' HIS . 90.7 m -65.26 -38.28 89.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.877 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.608 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -62.25 -50.82 70.22 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.87 179.762 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.455 HD11 HD22 ' A' ' 40' ' ' LEU . 8.6 mt -62.01 -42.65 95.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.713 0.292 . . . . 0.0 110.275 179.511 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -63.91 -41.89 97.55 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.957 0.408 . . . . 0.0 110.1 179.206 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -65.93 -41.4 91.41 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.506 179.494 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.579 HD11 ' N ' ' A' ' 51' ' ' ALA . 0.3 OUTLIER -53.45 -62.92 1.34 Allowed 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 179.218 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.738 HD11 HG13 ' A' ' 19' ' ' VAL . 42.8 mt -54.74 -27.21 18.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 110.227 -0.286 . . . . 0.0 110.227 178.831 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.419 ' ND2' ' C ' ' A' ' 78' ' ' ASN . 0.0 OUTLIER -58.99 -39.98 83.46 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 178.0 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.424 ' HB2' ' HB1' ' A' ' 62' ' ' ALA . 0.0 OUTLIER -72.1 -30.62 65.27 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 114.844 -1.071 . . . . 0.0 109.944 178.613 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.846 ' O ' HD12 ' A' ' 84' ' ' LEU . 94.5 mt -63.66 -46.63 84.75 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 107.899 -1.148 . . . . 0.0 107.899 177.575 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 8.2 tt0 -59.98 -51.97 67.41 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 114.894 -1.048 . . . . 0.0 110.628 177.791 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.93 -25.43 68.14 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.384 -179.655 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -74.71 -47.6 30.52 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.837 0.351 . . . . 0.0 110.774 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.846 HD12 ' O ' ' A' ' 80' ' ' LEU . 1.1 mt -64.59 -25.37 67.94 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.809 179.742 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 -63.47 -33.29 75.25 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.923 0.392 . . . . 0.0 110.386 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.49 -31.9 63.99 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.491 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.563 HD23 ' O ' ' A' ' 87' ' ' LEU . 6.5 tt -68.77 -27.89 66.29 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.964 -179.899 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.462 ' O ' ' N ' ' A' ' 90' ' ' LYS . 21.0 mt-30 -80.91 -32.98 34.5 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.948 0.404 . . . . 0.0 111.24 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.541 ' CE1' ' O ' ' A' ' 87' ' ' LEU . 0.0 OUTLIER 42.88 -87.73 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.604 -179.447 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.462 ' N ' ' O ' ' A' ' 88' ' ' GLN . 1.8 mmmm 47.41 -174.78 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 120.929 0.395 . . . . 0.0 111.442 -179.946 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 162.94 -83.73 0.11 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.68 -0.771 . . . . 0.0 112.465 -179.818 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -117.99 -175.74 2.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.825 0.345 . . . . 0.0 110.894 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -153.96 157.51 39.27 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.119 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -83.84 136.97 33.92 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.89 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.82 36.48 22.03 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.931 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.527 ' HA ' HG11 ' A' ' 100' ' ' VAL . . . -92.5 123.95 36.19 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.026 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -138.62 -55.9 0.62 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.139 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 28.3 m -131.54 -58.62 0.98 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.823 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 4.2 m -128.62 119.78 25.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.777 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.527 HG11 ' HA ' ' A' ' 96' ' ' ALA . 13.8 m -150.02 31.07 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.104 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 20.0 tttt -92.32 140.09 29.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.88 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 13.1 p-10 -74.9 167.31 22.12 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.882 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -130.29 172.98 11.24 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.056 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -60.32 145.15 48.75 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.923 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 29.0 m-85 -82.89 146.63 28.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.979 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 21.4 t -98.15 -45.56 12.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.041 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' GLU . . . . . 0.46 ' HB3' HG13 ' A' ' 109' ' ' VAL . 2.5 mp0 -92.53 -18.12 23.56 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.262 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 65.07 34.1 9.02 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.866 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.497 HG23 ' O ' ' A' ' 109' ' ' VAL . 27.0 m -98.07 117.68 43.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.053 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 61.52 167.96 0.1 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.831 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -97.71 -31.7 12.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.897 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 . . . . . 0 C--O 1.25 1.107 0 CA-C-O 118.253 -0.88 . . . . 0.0 110.916 -179.974 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.488 1.44 0 CA-C-O 120.781 0.324 . . . . 0.0 111.194 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' MET . . . . . 0.722 ' SD ' HD11 ' A' ' 23' ' ' LEU . 2.9 ttp -59.39 136.59 58.02 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.89 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 43.9 t-20 -127.85 98.87 5.31 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.3 -179.819 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.913 HG22 ' HB ' ' A' ' 38' ' ' ILE . 18.3 pt -105.09 130.0 56.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.459 179.331 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 3.1 p -132.9 169.93 16.06 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.879 0.371 . . . . 0.0 111.052 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.443 ' HB3' ' HB2' ' A' ' 40' ' ' LEU . 25.0 p -162.84 136.71 6.14 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.314 -179.441 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -101.15 37.26 1.8 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.952 -179.781 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -140.82 -48.98 0.43 Allowed 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.592 179.625 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -123.11 174.27 7.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.55 179.78 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.5 pm0 -93.95 165.17 12.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.518 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.5 mm -90.98 114.33 28.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 121.012 0.434 . . . . 0.0 110.983 -179.514 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 11.2 p -99.57 150.0 36.39 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.004 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -56.98 -19.24 31.47 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.318 2.012 . . . . 0.0 111.755 178.88 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -76.8 -42.77 39.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.092 0.473 . . . . 0.0 110.257 179.27 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.562 ' O ' HG23 ' A' ' 19' ' ' VAL . 31.9 mt -72.62 -28.59 28.16 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 CA-C-N 115.575 -0.739 . . . . 0.0 109.446 178.908 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.41 ' O ' ' CB ' ' A' ' 20' ' ' ALA . 53.2 mtp180 -74.82 -45.84 40.7 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.609 178.696 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -67.35 -38.52 84.95 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.616 179.158 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.448 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 77.8 t60 -60.25 -61.74 2.38 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 179.075 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.796 HG13 HD11 ' A' ' 77' ' ' ILE . 18.9 t -60.56 -47.18 93.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 116.618 -0.264 . . . . 0.0 110.676 178.933 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.689 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -58.14 -44.91 88.1 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.354 0.501 . . . . 0.0 112.354 -179.962 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.448 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 0.9 OUTLIER -59.83 -32.84 71.03 Favored 'General case' 0 C--N 1.333 -0.146 0 C-N-CA 120.364 -0.534 . . . . 0.0 110.219 -179.542 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.547 ' O ' HD12 ' A' ' 26' ' ' LEU . 0.0 OUTLIER -73.1 -28.44 62.28 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.652 179.181 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.722 HD11 ' SD ' ' A' ' 2' ' ' MET . 5.1 mt -68.44 -53.86 20.8 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.954 0.406 . . . . 0.0 110.599 179.536 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.34 -23.81 62.82 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.233 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -79.22 -33.36 43.77 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 121.206 0.527 . . . . 0.0 110.113 179.346 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.892 HD23 ' CD1' ' A' ' 29' ' ' TRP . 6.1 mt -80.23 57.12 2.65 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.047 -179.718 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.36 -72.03 0.14 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.3 -179.861 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.44 ' HE2' ' CH2' ' A' ' 29' ' ' TRP . 3.1 tttt -52.82 -24.12 8.34 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.239 0.542 . . . . 0.0 111.105 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.892 ' CD1' HD23 ' A' ' 26' ' ' LEU . 37.6 m95 -84.03 -78.14 0.24 Allowed 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.875 -179.682 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.882 ' HA ' HD11 ' A' ' 33' ' ' LEU . 60.9 mt-30 -81.24 55.67 2.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.835 0.35 . . . . 0.0 111.207 -179.589 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.416 HG23 ' N ' ' A' ' 32' ' ' HIS . 5.9 t -80.39 -47.22 14.74 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.934 0.397 . . . . 0.0 110.584 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' HIS . . . . . 0.654 ' O ' HD12 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -91.59 -126.33 0.09 Allowed 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.664 179.818 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.892 ' O ' HD13 ' A' ' 34' ' ' ILE . 0.6 OUTLIER 73.34 152.51 0.13 Allowed 'General case' 0 N--CA 1.464 0.227 0 O-C-N 122.213 -0.304 . . . . 0.0 110.688 -179.696 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.892 HD13 ' O ' ' A' ' 33' ' ' LEU . 2.8 mm -137.54 99.04 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-O 120.739 0.304 . . . . 0.0 111.519 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 16.8 m120 61.08 78.1 0.33 Allowed Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.639 179.35 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.551 ' HB3' HG23 ' A' ' 53' ' ' ILE . 92.9 Cg_endo -80.54 154.43 20.94 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.652 2.235 . . . . 0.0 112.0 179.316 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -138.34 127.95 24.94 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.976 0.417 . . . . 0.0 111.411 -179.617 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.913 ' HB ' HG22 ' A' ' 4' ' ' ILE . 4.9 mp -120.32 137.2 54.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.929 179.708 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 28.1 mt -119.54 142.21 35.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.172 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.89 HD21 ' CG1' ' A' ' 73' ' ' ILE . 10.0 mt -120.36 130.15 54.27 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.97 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 14.9 m -125.22 -170.65 2.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.528 179.786 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.427 ' HG3' ' CD2' ' A' ' 47' ' ' PHE . 3.5 ttpt -158.67 141.41 14.44 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.431 0.634 . . . . 0.0 111.359 -179.7 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -131.32 156.86 79.56 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 115.113 -0.949 . . . . 0.0 109.217 179.143 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_exo -51.82 -24.46 18.54 Favored 'Trans proline' 0 C--O 1.232 0.198 0 C-N-CA 121.942 1.761 . . . . 0.0 112.375 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 34.5 tt0 -89.44 -6.71 56.28 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.501 -0.772 . . . . 0.0 112.778 -179.146 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 149.22 -162.56 29.02 Favored Glycine 0 C--O 1.225 -0.422 0 C-N-CA 120.269 -0.967 . . . . 0.0 112.205 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.427 ' CD2' ' HG3' ' A' ' 42' ' ' LYS . 18.5 m-85 -109.06 152.65 24.74 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.548 0.689 . . . . 0.0 112.026 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.648 HG22 ' CG ' ' A' ' 65' ' ' LYS . 63.8 t -126.51 141.01 47.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 114.829 -1.078 . . . . 0.0 110.912 -179.324 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -132.13 123.78 27.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.753 179.645 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.403 ' O ' HG23 ' A' ' 38' ' ' ILE . 2.7 m-20 -119.52 149.84 41.24 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.603 0.24 . . . . 0.0 110.855 -179.81 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.53 ' N ' HD11 ' A' ' 76' ' ' LEU . . . -147.3 139.89 24.78 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.72 0.295 . . . . 0.0 111.419 179.615 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.0 m -135.78 129.88 33.19 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.924 -0.399 . . . . 0.0 109.924 179.226 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.7 HG21 ' CD2' ' A' ' 33' ' ' LEU . 8.3 mt -133.03 140.42 47.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-O 121.177 0.513 . . . . 0.0 111.96 -179.326 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 8.6 m120 -100.89 118.72 37.49 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.496 -0.774 . . . . 0.0 110.775 179.212 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.4 ' HA ' ' HD3' ' A' ' 56' ' ' PRO . 5.9 p -111.05 146.27 34.16 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.153 179.327 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 55' ' ' THR . 32.3 Cg_exo -58.01 -17.52 31.51 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.27 1.98 . . . . 0.0 112.573 -179.451 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -118.67 23.68 11.33 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.581 -0.282 . . . . 0.0 111.572 -179.714 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 143.99 -165.2 27.38 Favored Glycine 0 C--N 1.331 0.263 0 C-N-CA 120.427 -0.892 . . . . 0.0 113.073 179.77 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.566 HG13 ' O ' ' A' ' 53' ' ' ILE . 18.4 t -139.84 142.77 31.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.802 0.334 . . . . 0.0 111.015 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.9 mt -118.64 146.39 44.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.947 0.403 . . . . 0.0 111.299 -179.659 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 21.6 t -139.37 145.3 27.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.807 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -154.03 151.64 29.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.2 0.524 . . . . 0.0 111.648 -179.682 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' SER . . . . . 0.441 ' HA ' HD12 ' A' ' 76' ' ' LEU . 0.8 OUTLIER -143.13 156.71 44.85 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.416 -0.811 . . . . 0.0 111.575 -179.393 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.599 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -151.43 105.86 0.29 Allowed Glycine 0 C--N 1.331 0.305 0 N-CA-C 111.487 -0.645 . . . . 0.0 111.487 179.443 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.648 ' CG ' HG22 ' A' ' 48' ' ' VAL . 0.1 OUTLIER -107.92 45.06 1.03 Allowed 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 -178.806 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 15.2 t-80 -75.74 156.15 34.89 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.732 0.301 . . . . 0.0 110.353 178.552 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -60.61 -27.48 67.78 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.323 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -97.89 120.73 38.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.031 0.443 . . . . 0.0 111.461 -179.307 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -48.15 -48.21 34.41 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.724 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 8.2 m-85 -66.4 -41.16 89.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.332 -179.338 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 60.1 m -64.99 -39.49 93.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.798 0.333 . . . . 0.0 110.699 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.599 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -61.72 -50.42 72.49 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.672 179.642 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.89 ' CG1' HD21 ' A' ' 40' ' ' LEU . 8.5 mt -60.87 -43.56 95.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.88 0.372 . . . . 0.0 110.324 179.515 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -63.93 -38.87 92.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.091 179.272 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -66.17 -44.77 83.08 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.409 179.343 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.53 HD11 ' N ' ' A' ' 51' ' ' ALA . 0.3 OUTLIER -51.4 -58.97 4.8 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 179.038 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.796 HD11 HG13 ' A' ' 19' ' ' VAL . 43.5 mt -57.36 -29.32 32.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 109.916 -0.402 . . . . 0.0 109.916 178.6 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -58.84 -30.54 67.75 Favored 'General case' 0 N--CA 1.442 -0.859 0 CA-C-O 121.192 0.52 . . . . 0.0 109.932 178.079 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.5 mptt -84.0 -27.93 28.07 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.387 -0.824 . . . . 0.0 109.834 178.612 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.717 ' O ' HD12 ' A' ' 84' ' ' LEU . 89.8 mt -63.74 -49.55 72.6 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 177.493 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.439 ' HG3' ' CD1' ' A' ' 29' ' ' TRP . 9.0 tt0 -60.26 -50.18 74.67 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 114.862 -1.063 . . . . 0.0 110.501 177.616 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.88 -25.14 68.15 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.098 -179.741 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 8.4 mt-30 -75.33 -45.68 37.97 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.926 0.393 . . . . 0.0 110.42 179.759 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.852 HD13 ' HB3' ' A' ' 29' ' ' TRP . 1.1 mt -65.81 -30.98 71.69 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.83 179.832 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 47.1 t30 -61.82 -27.75 68.99 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.698 -179.689 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 2.9 mmtt -72.59 -23.66 60.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.142 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.477 HD12 ' HA ' ' A' ' 84' ' ' LEU . 19.9 mt -69.56 -15.5 63.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.265 -179.976 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -76.62 -7.13 54.63 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.624 -0.262 . . . . 0.0 111.364 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 30.0 m80 -85.16 -67.78 0.78 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.786 0.327 . . . . 0.0 110.865 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 42.11 -164.39 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.601 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 118.22 35.77 0.99 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.518 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -108.03 96.3 6.28 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.804 0.335 . . . . 0.0 110.912 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -78.24 -28.52 47.85 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.152 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 10.1 mmt-85 -59.24 113.73 2.29 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.941 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.04 158.78 15.35 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.942 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -81.93 96.89 7.82 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.149 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -69.27 91.19 0.52 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.085 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 63.58 138.81 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.87 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -178.42 94.72 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.871 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.448 HG23 ' O ' ' A' ' 100' ' ' VAL . 10.6 m -138.28 79.9 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.125 180.0 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 3.2 pttt -112.3 -35.14 5.69 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.946 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 41.2 m-20 -89.62 139.1 30.88 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.906 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . 60.5 95.13 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.147 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 17.3 t-20 -115.07 75.11 0.91 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.885 179.912 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -165.66 -168.93 1.42 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.956 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 28.8 t -121.74 82.03 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.039 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -67.97 -64.51 0.85 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.839 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -148.97 -66.61 0.23 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.876 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.432 HG23 ' O ' ' A' ' 109' ' ' VAL . 5.4 m -140.23 100.16 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.137 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -118.83 -41.72 2.77 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.904 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -145.78 166.17 26.69 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.935 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 . . . . . 0 C--O 1.25 1.102 0 CA-C-O 118.212 -0.899 . . . . 0.0 110.866 179.976 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 8.6 t . . . . . 0 N--CA 1.487 1.412 0 CA-C-O 120.738 0.304 . . . . 0.0 111.146 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' MET . . . . . 0.47 ' HE1' ' HA ' ' A' ' 16' ' ' ARG . 0.1 OUTLIER -143.27 166.01 25.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.95 179.955 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -124.87 130.56 52.61 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.196 -179.795 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.432 HD11 ' SD ' ' A' ' 2' ' ' MET . 38.7 mt -132.7 126.84 55.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.833 179.867 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -133.63 162.2 32.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.988 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.424 ' HB3' ' HB2' ' A' ' 40' ' ' LEU . 21.5 p -164.08 136.92 5.1 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.631 -179.581 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.94 39.26 1.49 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.797 -179.891 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -140.6 -47.81 0.42 Allowed 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.687 179.824 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -133.64 -178.36 4.97 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.898 179.792 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -93.23 164.03 13.39 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.671 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 3.7 mm -90.31 121.05 40.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.886 0.374 . . . . 0.0 110.695 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 17.7 p -101.81 148.21 34.97 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.086 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -56.77 -19.75 32.35 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.413 2.076 . . . . 0.0 111.773 179.203 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -77.61 -40.66 41.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.223 0.535 . . . . 0.0 110.374 179.618 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 26.4 mt -73.09 -31.27 34.4 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.327 178.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.47 ' HA ' ' HE1' ' A' ' 2' ' ' MET . 6.8 mtt85 -72.64 -46.45 53.99 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.512 178.616 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -67.09 -34.81 78.44 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.332 178.828 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.431 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 78.7 t60 -59.4 -66.02 0.58 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.039 0.447 . . . . 0.0 109.968 178.909 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.683 HG12 HD21 ' A' ' 23' ' ' LEU . 15.7 t -61.41 -46.04 97.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.887 179.166 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.639 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -55.56 -48.25 75.07 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 111.601 0.222 . . . . 0.0 111.601 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.431 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 2.7 p30 -59.51 -28.82 67.39 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.885 0.374 . . . . 0.0 110.538 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.616 ' O ' HD12 ' A' ' 26' ' ' LEU . 18.2 mmt180 -74.75 -29.2 61.07 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.517 179.451 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.683 HD21 HG12 ' A' ' 19' ' ' VAL . 1.1 mt -69.44 -49.65 53.06 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.594 179.185 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.87 -24.96 62.85 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.915 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.45 -37.41 43.65 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.569 179.315 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.616 HD12 ' O ' ' A' ' 22' ' ' ARG . 2.6 mt -82.27 55.92 3.04 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.81 179.625 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -118.15 20.96 13.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.564 -179.745 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.63 -6.24 33.69 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.754 0.312 . . . . 0.0 111.195 179.74 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.895 ' CD1' HD13 ' A' ' 84' ' ' LEU . 30.8 m95 -86.61 -175.77 5.56 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.033 -179.756 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 2.1 mm100 -128.32 74.3 1.54 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.296 0.57 . . . . 0.0 111.161 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.699 ' O ' HD13 ' A' ' 33' ' ' LEU . 14.9 t -162.32 87.52 0.63 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.088 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' HIS . . . . . 0.446 ' O ' HG22 ' A' ' 55' ' ' THR . 12.2 m-70 -48.2 101.25 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.636 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.891 ' H ' HD22 ' A' ' 33' ' ' LEU . 0.6 OUTLIER -64.98 128.0 33.93 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.044 -0.525 . . . . 0.0 109.76 -179.868 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.677 HG22 ' OD1' ' A' ' 35' ' ' ASN . 6.1 mt -127.5 116.61 44.24 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.259 0 CA-C-O 121.811 0.815 . . . . 0.0 112.143 -178.744 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.677 ' OD1' HG22 ' A' ' 34' ' ' ILE . 18.2 m120 73.45 48.0 0.22 Allowed Pre-proline 0 C--N 1.322 -0.615 0 CA-C-N 114.227 -1.352 . . . . 0.0 111.922 178.834 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.443 ' CD ' ' N ' ' A' ' 35' ' ' ASN . 16.0 Cg_endo -57.93 129.17 31.96 Favored 'Trans proline' 0 C--N 1.343 0.289 0 C-N-CA 122.207 1.938 . . . . 0.0 111.745 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' HIS . . . . . 0.443 ' O ' HD13 ' A' ' 38' ' ' ILE . 2.0 t-160 -134.01 132.63 40.33 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.03 0.443 . . . . 0.0 111.521 -179.711 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.443 HD13 ' O ' ' A' ' 37' ' ' HIS . 24.5 mm -123.19 133.7 68.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.773 179.726 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 37.0 mt -120.63 142.21 37.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.875 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.564 HD21 ' CG1' ' A' ' 73' ' ' ILE . 6.1 mt -121.48 127.41 51.04 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.988 0.423 . . . . 0.0 110.813 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -124.47 -171.35 2.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.602 179.813 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.482 ' HA ' ' HA ' ' A' ' 47' ' ' PHE . 0.0 OUTLIER -172.73 146.33 1.62 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.191 0.52 . . . . 0.0 111.018 -179.758 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.438 ' HB3' ' HD2' ' A' ' 44' ' ' PRO . 30.2 mm-40 -131.9 166.89 25.0 Favored Pre-proline 0 C--N 1.324 -0.527 0 CA-C-N 115.415 -0.811 . . . . 0.0 109.11 179.137 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' PRO . . . . . 0.438 ' HD2' ' HB3' ' A' ' 43' ' ' GLU . 71.4 Cg_exo -49.35 -20.35 3.69 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 121.764 1.643 . . . . 0.0 112.443 -179.327 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 28.9 tt0 -85.44 -76.89 0.31 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.122 179.156 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.445 ' HA3' ' HA ' ' A' ' 67' ' ' GLU . . . -142.44 -156.79 6.91 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.688 -0.767 . . . . 0.0 112.645 -179.339 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.482 ' HA ' ' HA ' ' A' ' 42' ' ' LYS . 21.4 m-85 -108.17 151.05 26.44 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.607 0.718 . . . . 0.0 112.58 -179.315 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.525 HG22 ' HG2' ' A' ' 65' ' ' LYS . 63.5 t -124.61 142.61 40.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 114.543 -1.208 . . . . 0.0 110.537 -179.775 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.439 ' O ' ' HA ' ' A' ' 63' ' ' SER . . . -133.09 125.17 29.0 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.026 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -118.39 145.69 44.98 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.356 179.765 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.753 ' CB ' HD11 ' A' ' 76' ' ' LEU . . . -144.69 142.2 29.89 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.798 -0.361 . . . . 0.0 111.602 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.604 ' O ' HD13 ' A' ' 53' ' ' ILE . 9.2 m -136.14 135.6 39.38 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.582 179.735 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.647 ' O ' HG13 ' A' ' 59' ' ' VAL . 4.0 mm -132.51 133.63 59.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.709 0.29 . . . . 0.0 110.915 -179.91 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -108.98 121.81 45.92 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.529 179.386 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.611 HG21 ' OG1' ' A' ' 31' ' ' THR . 28.4 p -121.67 164.99 21.49 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.1 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.41 ' HD3' ' O ' ' A' ' 32' ' ' HIS . 20.0 Cg_exo -65.9 -11.73 32.18 Favored 'Trans proline' 0 C--N 1.343 0.288 0 C-N-CA 122.785 2.323 . . . . 0.0 112.763 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -111.06 -3.39 15.51 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 111.819 0.303 . . . . 0.0 111.819 -179.601 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 152.39 -167.2 31.34 Favored Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.467 -0.873 . . . . 0.0 112.765 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.647 HG13 ' O ' ' A' ' 53' ' ' ILE . 17.2 t -131.95 140.65 47.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.73 0.3 . . . . 0.0 111.144 -179.884 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.7 mt -117.54 153.81 32.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.889 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 13.8 p -140.42 149.62 21.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.307 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.502 ' O ' HD12 ' A' ' 76' ' ' LEU . . . -153.99 154.73 34.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.098 0.475 . . . . 0.0 111.411 -179.824 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' SER . . . . . 0.439 ' HA ' ' O ' ' A' ' 49' ' ' ALA . 0.1 OUTLIER -144.79 157.31 44.22 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.753 -179.315 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.762 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -151.87 105.16 0.28 Allowed Glycine 0 C--N 1.331 0.304 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.61 179.4 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.525 ' HG2' HG22 ' A' ' 48' ' ' VAL . 8.7 mtpt -107.62 44.73 1.06 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -178.65 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.651 ' ND1' HG21 ' A' ' 71' ' ' THR . 13.9 t-80 -76.18 156.29 33.8 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.877 0.37 . . . . 0.0 110.421 178.522 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.445 ' HA ' ' HA3' ' A' ' 46' ' ' GLY . 1.2 tt0 -60.88 -26.9 67.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.786 0.327 . . . . 0.0 111.119 179.844 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -97.59 123.93 41.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.028 0.442 . . . . 0.0 111.458 -179.292 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 17.1 ttt -48.2 -50.27 29.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.834 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' TYR . . . . . 0.404 ' HA ' HD12 ' A' ' 73' ' ' ILE . 46.4 m-85 -66.24 -36.74 83.79 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.635 -179.118 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.651 HG21 ' ND1' ' A' ' 66' ' ' HIS . 98.7 m -64.34 -42.28 96.35 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.721 0.296 . . . . 0.0 110.529 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.762 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -61.2 -47.52 85.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.37 179.442 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.604 ' CG2' HG22 ' A' ' 19' ' ' VAL . 14.7 mt -60.35 -47.11 93.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.548 179.645 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -63.96 -39.14 93.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.596 179.65 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -65.49 -44.97 85.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.469 179.576 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.753 HD11 ' CB ' ' A' ' 51' ' ' ALA . 0.2 OUTLIER -53.01 -57.84 9.0 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 179.194 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.603 HD11 HG13 ' A' ' 19' ' ' VAL . 9.3 mt -57.01 -31.97 38.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 178.824 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -59.11 -30.06 67.83 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-O 121.139 0.495 . . . . 0.0 110.324 178.458 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.483 ' HB2' ' HB1' ' A' ' 62' ' ' ALA . 3.8 mptt -84.65 -25.71 28.31 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.217 179.092 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.439 HD12 ' HA ' ' A' ' 77' ' ' ILE . 90.5 mt -62.21 -48.87 78.08 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 107.599 -1.26 . . . . 0.0 107.599 177.111 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.709 ' HA ' HD12 ' A' ' 84' ' ' LEU . 4.2 tt0 -60.22 -44.63 95.03 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 114.362 -1.29 . . . . 0.0 110.549 177.585 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 85.3 mtt180 -61.59 -31.38 71.43 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.882 -179.703 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 17.0 mt-30 -75.61 -39.78 57.39 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.936 0.398 . . . . 0.0 110.438 179.624 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.895 HD13 ' CD1' ' A' ' 29' ' ' TRP . 6.5 mt -66.09 -30.33 70.82 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.826 179.611 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -63.69 -22.64 67.01 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.908 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.467 ' O ' ' CG ' ' A' ' 89' ' ' HIS . 5.6 mmtm -71.59 -35.01 70.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.62 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.734 HD12 ' HA ' ' A' ' 84' ' ' LEU . 1.7 mt -72.36 -22.6 61.13 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.259 179.755 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.528 HE21 ' HZ3' ' A' ' 29' ' ' TRP . 8.7 mt-30 -77.85 1.74 19.43 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.493 0.553 . . . . 0.0 112.493 -179.113 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.467 ' CG ' ' O ' ' A' ' 86' ' ' LYS . 0.0 OUTLIER -79.55 168.49 19.34 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.135 0.493 . . . . 0.0 111.512 -179.414 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -171.1 74.82 0.06 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.898 179.532 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 162.99 94.24 0.1 OUTLIER Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.488 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -73.37 80.97 1.39 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.85 0.357 . . . . 0.0 110.954 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . 59.42 94.65 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.203 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.88 165.7 0.06 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.894 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 10.6 mtm180 -141.35 -48.89 0.4 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.934 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -139.84 126.71 20.74 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.102 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . 60.45 -176.15 0.11 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.134 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 1.2 p -82.33 -63.23 1.42 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.855 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 67.5 m -128.23 148.46 50.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.853 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 29.5 t -80.18 82.54 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.112 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 30.3 mmtm -94.19 -34.61 12.85 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.89 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' ASP . . . . . 0.472 ' HB2' HG12 ' A' ' 106' ' ' VAL . 71.3 m-20 -75.76 149.31 38.01 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.893 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -115.79 154.36 29.77 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.057 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 12.1 t-20 68.99 -67.47 0.21 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.912 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -139.1 114.35 9.6 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.791 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.472 HG12 ' HB2' ' A' ' 102' ' ' ASP . 27.4 m -69.11 -35.75 70.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.176 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -156.69 167.71 29.62 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.843 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -103.55 -74.6 0.63 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.868 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 11.1 p -67.18 142.43 16.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.091 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -120.28 137.98 53.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.913 179.918 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -102.43 -48.39 4.18 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.962 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.203 -0.903 . . . . 0.0 110.84 -179.997 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 2.2 m . . . . . 0 N--CA 1.487 1.416 0 CA-C-O 120.844 0.354 . . . . 0.0 111.173 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' MET . . . . . 0.531 ' SD ' HD11 ' A' ' 23' ' ' LEU . 2.5 tpt 60.18 87.77 0.08 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.852 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -124.24 116.49 22.76 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.484 -179.651 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 35.2 mt -118.98 125.23 74.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.396 179.389 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -134.35 162.63 31.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.907 0.384 . . . . 0.0 111.313 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.452 ' HB3' ' HB2' ' A' ' 40' ' ' LEU . 21.5 p -162.32 143.25 10.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.35 -179.744 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -102.81 -11.79 18.05 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.626 -179.452 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.03 -25.07 14.43 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 120.757 0.313 . . . . 0.0 111.132 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 1.4 mpp? -137.69 -165.98 1.87 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.871 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 13.6 tt0 -124.02 164.54 19.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.64 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.515 HG22 ' HG3' ' A' ' 16' ' ' ARG . 4.9 mm -91.2 111.32 23.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 121.075 0.464 . . . . 0.0 111.223 -179.497 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 15.1 p -98.22 152.72 38.13 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.034 179.807 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -58.5 -18.82 41.23 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.416 2.077 . . . . 0.0 111.757 179.278 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -79.19 -43.19 24.39 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.976 0.417 . . . . 0.0 110.519 179.27 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.48 ' O ' HG23 ' A' ' 19' ' ' VAL . 30.4 mt -72.26 -28.8 29.95 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.412 178.965 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.515 ' HG3' HG22 ' A' ' 11' ' ' ILE . 19.5 mtm180 -74.63 -44.98 47.83 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.569 178.797 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 19.0 tt0 -67.69 -39.25 84.44 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.761 179.094 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.534 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 78.2 t60 -60.14 -58.18 9.64 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.623 -0.431 . . . . 0.0 109.881 179.018 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.859 HG13 HD11 ' A' ' 77' ' ' ILE . 44.3 t -60.86 -47.54 92.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-O 120.714 0.293 . . . . 0.0 110.258 178.453 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.693 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -58.25 -42.74 87.07 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.204 0.446 . . . . 0.0 112.204 179.77 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.534 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 0.9 OUTLIER -59.2 -35.83 74.3 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 121.007 0.432 . . . . 0.0 110.243 -179.898 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.559 ' O ' HD12 ' A' ' 26' ' ' LEU . 5.2 mmm180 -76.09 -25.98 56.0 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.581 179.458 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.693 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 3.3 mt -68.31 -56.93 6.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.136 0.493 . . . . 0.0 110.393 179.542 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.08 -25.04 66.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.675 -179.866 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 7.8 tmtm? -79.11 -41.03 29.58 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.057 0.456 . . . . 0.0 110.506 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.709 ' HB3' ' HB2' ' A' ' 29' ' ' TRP . 7.0 mt -81.04 55.02 2.36 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.688 179.788 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -50.93 -63.97 0.96 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.375 -179.654 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.464 ' HG2' ' CD1' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -51.57 -34.22 36.0 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.296 0.569 . . . . 0.0 111.152 -179.891 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.709 ' HB2' ' HB3' ' A' ' 26' ' ' LEU . 9.2 m95 -90.01 48.71 1.61 Allowed 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.293 -0.867 . . . . 0.0 111.31 -179.581 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.632 ' HG2' HD12 ' A' ' 33' ' ' LEU . 3.5 mt-30 170.92 97.91 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.347 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.43 ' CG2' ' N ' ' A' ' 32' ' ' HIS . 2.0 t -159.56 -47.78 0.05 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.018 -179.709 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' HIS . . . . . 0.43 ' N ' ' CG2' ' A' ' 31' ' ' THR . 18.0 m170 -82.35 -18.27 42.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.901 179.761 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.818 HD22 HG21 ' A' ' 53' ' ' ILE . 53.6 mt -57.44 153.85 11.96 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.863 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.493 HG22 ' OD1' ' A' ' 35' ' ' ASN . 29.0 mt -140.48 104.15 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.425 -179.911 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.493 ' OD1' HG22 ' A' ' 34' ' ' ILE . 6.6 m120 57.71 76.77 0.45 Allowed Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.281 179.579 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -79.32 152.52 23.73 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.607 2.205 . . . . 0.0 112.022 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 2.0 t-160 -136.64 127.21 26.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.121 -179.7 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.634 HD12 ' N ' ' A' ' 38' ' ' ILE . 3.3 mp -119.58 135.24 60.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.92 179.808 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.53 ' C ' HD22 ' A' ' 40' ' ' LEU . 5.5 mt -116.54 142.94 27.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.808 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.53 HD22 ' C ' ' A' ' 39' ' ' ILE . 3.7 mm? -116.29 127.47 54.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.068 -179.867 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -123.5 -174.71 3.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.303 179.586 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.433 ' HG3' ' CD2' ' A' ' 47' ' ' PHE . 2.2 ttpp -159.99 139.35 11.05 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.282 0.563 . . . . 0.0 111.303 -179.731 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -130.9 156.07 80.56 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-N 115.091 -0.958 . . . . 0.0 109.241 179.161 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_exo -51.34 -24.39 15.77 Favored 'Trans proline' 0 N--CA 1.465 -0.186 0 C-N-CA 121.936 1.757 . . . . 0.0 112.464 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.31 -6.56 56.61 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.439 -0.8 . . . . 0.0 112.654 -179.177 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 149.82 -162.42 29.13 Favored Glycine 0 C--O 1.224 -0.483 0 C-N-CA 120.248 -0.977 . . . . 0.0 112.222 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.433 ' CD2' ' HG3' ' A' ' 42' ' ' LYS . 17.9 m-85 -110.01 154.55 23.02 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.425 0.631 . . . . 0.0 111.986 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.668 HG22 ' CB ' ' A' ' 65' ' ' LYS . 55.4 t -129.19 139.04 52.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 114.966 -1.015 . . . . 0.0 111.064 -179.297 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.403 ' O ' ' HA ' ' A' ' 63' ' ' SER . . . -129.82 123.34 30.67 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.265 179.47 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -119.08 149.67 41.29 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.718 0.294 . . . . 0.0 111.051 -179.933 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.473 ' N ' HD11 ' A' ' 76' ' ' LEU . . . -145.85 140.16 26.86 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.437 179.746 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.1 m -134.86 130.72 36.43 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.018 179.51 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.818 HG21 HD22 ' A' ' 33' ' ' LEU . 6.7 mt -132.69 137.3 54.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 121.047 0.451 . . . . 0.0 111.68 -179.478 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -102.28 134.96 44.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.796 179.283 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.47 HG22 HD23 ' A' ' 33' ' ' LEU . 6.0 p -129.88 160.55 64.46 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.418 179.75 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.45 ' HG3' HD11 ' A' ' 34' ' ' ILE . 16.2 Cg_exo -67.59 -10.51 28.97 Favored 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.461 2.108 . . . . 0.0 112.687 -179.68 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -115.79 -3.94 12.18 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 111.801 0.297 . . . . 0.0 111.801 -179.697 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 159.25 -167.12 34.91 Favored Glycine 0 C--N 1.331 0.282 0 C-N-CA 120.391 -0.909 . . . . 0.0 112.82 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.534 HG13 ' O ' ' A' ' 53' ' ' ILE . 15.4 t -131.64 140.89 47.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 120.802 0.334 . . . . 0.0 111.163 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.712 HD23 ' HB3' ' A' ' 83' ' ' GLN . 6.5 mp -116.47 151.6 35.75 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.045 -179.822 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 14.1 p -139.96 149.05 22.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.147 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -154.93 150.2 27.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.302 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' SER . . . . . 0.527 ' HA ' HD12 ' A' ' 76' ' ' LEU . 0.9 OUTLIER -145.8 156.49 43.62 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.783 -179.402 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.781 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -150.04 104.6 0.28 Allowed Glycine 0 CA--C 1.519 0.335 0 N-CA-C 111.37 -0.692 . . . . 0.0 111.37 179.287 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.668 ' CB ' HG22 ' A' ' 48' ' ' VAL . 6.0 mtmt -106.93 45.11 1.0 Allowed 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -178.625 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.57 ' ND1' HG21 ' A' ' 71' ' ' THR . 12.3 t-80 -75.72 156.91 34.23 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 178.572 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.4 pm0 -60.17 -27.24 66.95 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.759 0.314 . . . . 0.0 111.263 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -98.63 118.43 35.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.975 0.417 . . . . 0.0 111.301 -179.553 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 11.5 ttt -47.43 -45.04 25.3 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.559 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 8.5 m-85 -66.7 -39.67 88.17 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.072 -179.716 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.57 HG21 ' ND1' ' A' ' 66' ' ' HIS . 93.2 m -65.41 -38.79 91.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.73 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.781 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -61.62 -50.8 71.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.758 179.644 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.61 HG21 HG22 ' A' ' 19' ' ' VAL . 6.8 mt -62.08 -41.18 90.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-O 120.741 0.305 . . . . 0.0 110.243 179.355 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -64.06 -41.72 97.26 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.923 0.392 . . . . 0.0 110.047 179.096 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 62.0 mt-10 -67.26 -41.08 86.17 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.829 179.502 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.527 HD12 ' HA ' ' A' ' 63' ' ' SER . 0.4 OUTLIER -54.64 -64.78 0.72 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.326 179.662 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.859 HD11 HG13 ' A' ' 19' ' ' VAL . 55.5 mt -55.85 -26.79 21.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.567 -0.288 . . . . 0.0 110.272 178.929 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -58.53 -39.62 80.66 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 178.066 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.16 -30.86 63.88 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.834 -1.076 . . . . 0.0 110.287 178.754 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.818 ' O ' HD12 ' A' ' 84' ' ' LEU . 90.3 mt -61.66 -45.2 95.06 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 107.61 -1.256 . . . . 0.0 107.61 177.451 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.422 ' O ' ' CZ3' ' A' ' 29' ' ' TRP . 21.9 tt0 -57.33 -52.57 64.83 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 114.807 -1.088 . . . . 0.0 110.287 177.332 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 39.7 mtt180 -65.18 -16.55 63.64 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.566 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.712 ' HB3' HD23 ' A' ' 60' ' ' LEU . 8.2 mt-30 -75.44 -55.3 5.83 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.564 0.221 . . . . 0.0 111.067 -179.826 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.818 HD12 ' O ' ' A' ' 80' ' ' LEU . 2.5 mp -64.12 -27.68 69.25 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.089 0.471 . . . . 0.0 110.456 179.62 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ASN . . . . . 0.476 ' N ' ' HZ3' ' A' ' 29' ' ' TRP . 11.8 t-20 -61.92 -36.27 80.87 Favored 'General case' 0 CA--C 1.521 -0.157 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.352 -179.27 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.439 ' O ' ' CD2' ' A' ' 89' ' ' HIS . 8.4 mmtm -73.0 -33.0 65.51 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.11 -179.757 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.586 HD12 ' HA ' ' A' ' 84' ' ' LEU . 2.7 mt -70.0 -12.19 61.43 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.558 -179.88 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 7.2 mt-30 -77.63 -8.76 58.36 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 111.979 0.362 . . . . 0.0 111.979 -179.493 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.439 ' CD2' ' O ' ' A' ' 86' ' ' LYS . 0.1 OUTLIER -85.93 175.6 8.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.961 0.41 . . . . 0.0 111.326 -179.831 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 6.1 mmmt 76.59 -67.9 0.2 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.083 179.64 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 98.39 87.21 1.88 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.283 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 63.16 117.98 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.833 0.349 . . . . 0.0 110.76 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.17 -70.88 0.25 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.117 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 11.0 ptt-85 -146.46 121.92 10.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.863 180.0 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.45 -32.32 6.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.924 -179.966 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -130.86 147.86 52.56 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.149 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -173.99 107.22 0.13 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.095 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' THR . . . . . 0.474 HG22 ' H ' ' A' ' 99' ' ' SER . 0.2 OUTLIER 60.12 -176.31 0.1 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.931 179.974 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 99' ' ' SER . . . . . 0.474 ' H ' HG22 ' A' ' 98' ' ' THR . 3.1 p -157.17 -46.0 0.07 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.865 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 9.0 p -104.32 -25.63 3.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.142 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 3.6 mtpm? 61.46 175.92 0.12 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.914 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -133.91 32.12 3.54 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.968 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.69 -31.39 72.59 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.077 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' ASN . . . . . 0.689 ' HB3' HG22 ' A' ' 109' ' ' VAL . 2.1 m-80 -153.25 -46.97 0.09 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.889 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.487 ' O ' HG13 ' A' ' 106' ' ' VAL . 2.1 t80 -176.42 -54.8 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.908 180.0 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.487 HG13 ' O ' ' A' ' 105' ' ' PHE . 6.1 m -157.42 89.93 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.107 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 60.8 50.65 5.25 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.857 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 44.0 mm-40 60.72 112.47 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.952 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.689 HG22 ' HB3' ' A' ' 104' ' ' ASN . 8.0 m -115.76 135.43 55.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.085 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -130.63 122.69 27.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.881 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -111.76 -34.55 6.0 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.921 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.243 -0.884 . . . . 0.0 110.9 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' THR . . . . . 0.432 HG23 ' O ' ' A' ' 1' ' ' THR . 9.2 t . . . . . 0 N--CA 1.487 1.376 0 CA-C-O 120.841 0.353 . . . . 0.0 111.173 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' MET . . . . . 0.71 ' CG ' HD11 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -126.95 175.63 7.92 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.944 179.887 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 39.4 t-20 -113.56 142.17 46.29 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.485 -179.689 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.639 ' CG2' HD11 ' A' ' 40' ' ' LEU . 21.2 mt -131.37 123.84 53.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.597 179.499 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.8 p -134.92 157.5 46.7 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.947 0.403 . . . . 0.0 111.31 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.46 ' HB3' HD12 ' A' ' 40' ' ' LEU . 21.7 p -163.32 143.32 8.82 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.508 -179.733 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.4 mtmt -101.05 12.56 37.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.294 -179.764 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -142.43 25.87 1.83 Allowed 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.801 179.587 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 2.4 mtm 179.37 172.51 0.89 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.859 -179.797 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 14.0 pm0 -114.9 168.41 9.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.477 179.583 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.631 HG22 ' HG3' ' A' ' 16' ' ' ARG . 6.5 mm -89.94 107.99 18.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 121.061 0.457 . . . . 0.0 111.349 -179.263 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 14.1 p -97.28 150.98 37.4 Favored Pre-proline 0 C--N 1.327 -0.389 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.831 179.714 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_endo -56.08 -26.8 61.57 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.475 2.117 . . . . 0.0 111.66 179.069 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -71.43 -44.6 64.54 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.634 179.47 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.681 ' O ' HG23 ' A' ' 19' ' ' VAL . 34.7 mt -72.19 -27.92 27.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 178.953 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.631 ' HG3' HG22 ' A' ' 11' ' ' ILE . 63.1 mtm180 -76.39 -44.63 35.3 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.776 178.778 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -67.75 -40.37 84.1 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.686 179.14 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.509 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 41.5 t-80 -60.57 -58.0 10.35 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 179.07 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.681 HG23 ' O ' ' A' ' 15' ' ' ILE . 22.0 t -60.01 -47.49 91.59 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.447 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 178.554 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.718 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -59.4 -39.66 84.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.934 179.654 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.509 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 0.9 OUTLIER -59.64 -34.75 73.2 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 121.134 0.492 . . . . 0.0 109.924 179.915 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.738 ' O ' HD12 ' A' ' 26' ' ' LEU . 36.5 mmt180 -75.55 -25.4 57.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.713 179.35 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.718 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 14.8 mt -66.98 -55.82 12.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.104 0.478 . . . . 0.0 110.083 179.199 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.57 -21.92 63.12 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.135 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -78.91 -30.58 44.92 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.119 0.485 . . . . 0.0 110.312 179.375 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.738 HD12 ' O ' ' A' ' 22' ' ' ARG . 0.5 OUTLIER -80.29 58.24 3.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.561 179.691 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.45 -79.48 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.647 -179.432 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.443 ' HG3' ' N ' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -49.66 -27.97 5.34 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-O 121.33 0.586 . . . . 0.0 111.164 -179.683 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.582 ' CG ' HD23 ' A' ' 26' ' ' LEU . 10.8 m95 -88.52 52.87 2.55 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.247 -0.888 . . . . 0.0 111.008 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -145.83 50.28 1.19 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.478 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -77.75 -165.63 0.66 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.955 -179.754 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' HIS . . . . . 0.46 ' O ' HG22 ' A' ' 55' ' ' THR . 47.8 m-70 -50.38 108.18 0.21 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.048 0.451 . . . . 0.0 111.812 -179.34 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.709 HD22 HG21 ' A' ' 53' ' ' ILE . 1.0 OUTLIER -134.95 145.75 48.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.613 179.24 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.621 ' N ' HD12 ' A' ' 34' ' ' ILE . 3.1 mp -137.06 111.33 9.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 121.584 0.707 . . . . 0.0 112.371 -179.382 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 7.2 m120 52.53 77.12 0.47 Allowed Pre-proline 0 C--N 1.327 -0.384 0 CA-C-N 114.654 -1.157 . . . . 0.0 112.646 178.856 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -80.02 145.71 17.72 Favored 'Trans proline' 0 N--CA 1.461 -0.401 0 C-N-CA 122.541 2.161 . . . . 0.0 110.966 178.335 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 1.4 t-160 -134.49 128.91 34.34 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.104 0.478 . . . . 0.0 112.155 -178.909 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.45 HD12 ' N ' ' A' ' 38' ' ' ILE . 4.9 mp -119.49 133.52 66.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.152 179.189 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.412 HG22 ' N ' ' A' ' 40' ' ' LEU . 38.4 mt -116.43 154.39 18.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.908 0.385 . . . . 0.0 111.51 -179.51 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.639 HD11 ' CG2' ' A' ' 4' ' ' ILE . 0.8 OUTLIER -127.28 126.01 41.89 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.711 179.773 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 3.2 m -123.18 -176.67 3.48 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.655 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.501 ' HG3' ' CE2' ' A' ' 47' ' ' PHE . 0.1 OUTLIER -158.42 138.1 11.97 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.324 0.583 . . . . 0.0 111.26 -179.63 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -130.74 155.49 81.25 Favored Pre-proline 0 C--N 1.322 -0.614 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.393 179.285 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -51.16 -24.69 15.41 Favored 'Trans proline' 0 C--O 1.232 0.221 0 C-N-CA 122.013 1.809 . . . . 0.0 112.372 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.41 -6.5 56.51 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.582 -0.736 . . . . 0.0 112.612 -179.15 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 150.12 -162.58 29.25 Favored Glycine 0 C--O 1.224 -0.477 0 C-N-CA 120.245 -0.978 . . . . 0.0 112.3 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.501 ' CE2' ' HG3' ' A' ' 42' ' ' LYS . 11.3 m-85 -109.92 155.25 21.98 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.435 0.636 . . . . 0.0 111.927 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.635 HG22 ' CB ' ' A' ' 65' ' ' LYS . 49.1 t -129.2 139.09 52.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 114.945 -1.025 . . . . 0.0 111.205 -179.198 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -130.49 122.94 28.58 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.444 179.44 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -119.64 149.77 41.43 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.828 0.347 . . . . 0.0 111.017 -179.672 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.615 ' N ' HD11 ' A' ' 76' ' ' LEU . . . -145.28 139.39 27.06 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.166 179.567 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.0 m -135.43 130.94 35.58 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.251 179.602 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.709 HG21 HD22 ' A' ' 33' ' ' LEU . 16.1 mt -132.72 135.27 57.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 120.912 0.387 . . . . 0.0 111.412 -179.653 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -103.13 134.49 46.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.442 179.365 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.477 ' HB ' ' HD2' ' A' ' 56' ' ' PRO . 58.1 p -133.07 157.44 78.31 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.561 179.809 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.477 ' HD2' ' HB ' ' A' ' 55' ' ' THR . 43.1 Cg_endo -68.31 -7.34 19.82 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.302 2.001 . . . . 0.0 112.716 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 88.5 m-20 -124.14 22.93 8.58 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.591 0.234 . . . . 0.0 111.604 -179.803 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 138.69 -165.51 25.55 Favored Glycine 0 C--N 1.331 0.294 0 C-N-CA 120.406 -0.902 . . . . 0.0 112.964 179.728 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.495 HG13 ' O ' ' A' ' 53' ' ' ILE . 21.4 t -142.4 144.53 24.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.766 0.317 . . . . 0.0 111.122 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.676 HD21 ' HG ' ' A' ' 84' ' ' LEU . 8.4 mp -118.7 142.82 47.31 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.306 -179.667 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 21.4 t -140.81 142.33 30.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.907 179.76 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.512 ' O ' HD12 ' A' ' 76' ' ' LEU . . . -153.51 154.39 34.24 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.257 0.551 . . . . 0.0 111.609 -179.708 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 80.3 p -145.09 159.55 42.79 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.828 -179.263 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.789 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -152.61 102.8 0.23 Allowed Glycine 0 C--N 1.331 0.305 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.47 179.466 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.635 ' CB ' HG22 ' A' ' 48' ' ' VAL . 0.0 OUTLIER -105.42 44.33 1.05 Allowed 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -178.771 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 12.5 t-80 -75.23 156.28 35.92 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.589 -0.278 . . . . 0.0 110.253 178.57 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -60.2 -27.25 67.01 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.727 0.299 . . . . 0.0 111.364 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 32.5 t0 -97.66 116.53 30.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.931 0.396 . . . . 0.0 111.191 -179.375 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.41 ' O ' HD12 ' A' ' 73' ' ' ILE . 1.4 ttt -46.92 -44.06 19.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.414 179.821 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -66.81 -42.38 85.98 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.886 -179.688 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 71.5 m -65.75 -37.51 86.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.917 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.789 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -61.96 -52.93 62.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.958 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.443 HG21 HG22 ' A' ' 19' ' ' VAL . 6.3 mt -61.6 -41.32 89.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.827 0.346 . . . . 0.0 110.235 179.505 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -63.7 -40.0 95.72 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.267 -0.424 . . . . 0.0 109.929 179.068 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -66.35 -41.6 89.3 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.478 179.293 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.711 HD23 HG13 ' A' ' 77' ' ' ILE . 0.2 OUTLIER -52.74 -62.32 1.72 Allowed 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 179.042 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.711 HG13 HD23 ' A' ' 76' ' ' LEU . 4.9 mt -55.9 -29.14 25.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 178.507 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -59.26 -30.51 68.34 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-O 121.112 0.482 . . . . 0.0 110.14 178.27 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.447 ' CE ' ' HA ' ' A' ' 79' ' ' LYS . 0.1 OUTLIER -86.9 -28.02 23.05 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.446 179.069 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.773 ' O ' HD12 ' A' ' 84' ' ' LEU . 92.5 mt -63.73 -48.82 75.51 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.048 -1.094 . . . . 0.0 108.048 177.596 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -60.21 -49.87 75.9 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 114.984 -1.007 . . . . 0.0 110.462 177.741 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 3.6 mtt180 -63.92 -25.51 68.18 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.476 -179.535 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 23.7 mt-30 -73.87 -45.93 47.95 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.811 0.339 . . . . 0.0 110.703 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.773 HD12 ' O ' ' A' ' 80' ' ' LEU . 0.9 OUTLIER -64.84 -28.61 69.67 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.799 179.835 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -62.38 -28.64 69.92 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.003 0.43 . . . . 0.0 110.308 179.619 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.458 ' HA ' ' CE1' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -72.23 -30.4 64.86 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.394 179.628 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.424 ' N ' ' HG3' ' A' ' 86' ' ' LYS . 0.2 OUTLIER -66.42 -15.72 63.54 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.166 -179.745 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 18.7 mt-30 -76.51 -6.78 53.29 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.403 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.458 ' CE1' ' HA ' ' A' ' 86' ' ' LYS . 0.5 OUTLIER -86.29 -38.32 17.64 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.023 0.439 . . . . 0.0 110.713 179.749 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 13.3 mttt -69.12 154.88 41.32 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.98 -179.297 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -68.72 -24.36 75.45 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.62 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -56.39 103.72 0.12 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.847 0.356 . . . . 0.0 111.067 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -157.72 144.94 18.29 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.064 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 60.78 93.42 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.88 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 10.1 ttt-85 -154.12 96.07 1.91 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.923 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -152.82 163.24 40.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.055 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -152.24 121.64 6.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.108 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 75.7 p -72.26 139.87 48.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.892 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.9 m -138.02 148.6 45.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.928 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 21.4 t -137.12 -49.86 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.193 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 6.8 mttm -64.71 164.33 12.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.874 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 22.7 m-20 -78.89 166.16 22.71 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.915 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -134.55 32.81 3.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.039 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 3.8 t30 67.57 -70.35 0.12 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.037 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 47.1 p90 -122.71 -177.63 3.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.858 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 31.0 m -133.39 143.64 38.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.03 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 61.07 109.8 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.921 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -68.03 165.52 17.79 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.895 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.408 HG23 ' O ' ' A' ' 109' ' ' VAL . 5.3 m -147.7 104.27 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.165 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -161.0 114.38 1.99 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.901 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -123.15 178.85 4.91 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.88 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.926 179.986 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.487 1.422 0 CA-C-O 120.833 0.349 . . . . 0.0 111.218 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 59.93 109.45 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.854 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -125.31 134.61 52.18 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.236 -179.708 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.62 HG12 HD12 ' A' ' 11' ' ' ILE . 9.0 tt -135.09 125.94 45.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.349 179.72 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 3.0 p -134.76 165.33 25.53 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.901 0.381 . . . . 0.0 111.446 -179.641 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.4 ' HB3' ' HB2' ' A' ' 40' ' ' LEU . 3.2 p -161.59 130.42 4.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.978 -0.556 . . . . 0.0 109.991 -179.388 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 15.0 mtmt -99.0 13.67 31.92 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.271 -179.601 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 4.5 tp-100 -141.91 21.67 2.12 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.636 179.319 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 176.74 161.96 0.41 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.51 -179.754 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -96.62 160.28 14.47 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.21 179.39 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.62 HD12 HG12 ' A' ' 4' ' ' ILE . 3.9 mm -90.27 119.3 37.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.002 0.429 . . . . 0.0 111.202 -179.372 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.418 ' H ' HD12 ' A' ' 15' ' ' ILE . 16.8 p -100.58 157.27 34.05 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.641 179.434 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_exo -61.01 -15.08 36.74 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.477 2.118 . . . . 0.0 112.233 179.54 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -88.7 -38.72 14.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.904 0.383 . . . . 0.0 110.725 179.791 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.418 HD12 ' H ' ' A' ' 12' ' ' THR . 18.2 mt -73.57 -31.75 33.62 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 N-CA-C 109.484 -0.562 . . . . 0.0 109.484 179.028 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.412 ' O ' ' CB ' ' A' ' 20' ' ' ALA . 0.4 OUTLIER -72.55 -46.62 53.62 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.273 178.749 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -67.04 -33.64 75.97 Favored 'General case' 0 N--CA 1.456 -0.171 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.189 178.785 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.413 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 45.2 t-80 -58.85 -66.22 0.54 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.995 0.426 . . . . 0.0 109.854 178.659 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.677 HG12 HD21 ' A' ' 23' ' ' LEU . 12.2 t -61.39 -44.61 98.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.796 178.998 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.602 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -55.15 -50.13 70.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.56 179.703 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.413 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 3.1 p30 -59.02 -28.57 66.54 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-O 120.894 0.378 . . . . 0.0 110.567 -179.938 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.518 ' CB ' HD13 ' A' ' 77' ' ' ILE . 13.8 mmt180 -74.09 -28.84 61.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.447 179.349 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.677 HD21 HG12 ' A' ' 19' ' ' VAL . 1.1 mt -69.7 -47.35 63.5 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.304 179.086 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.99 -27.35 66.79 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.962 179.617 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -79.34 -31.91 43.17 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.775 179.539 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.59 HD11 ' CG2' ' A' ' 77' ' ' ILE . 10.1 mt -81.07 58.27 3.42 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.863 179.817 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -121.69 2.5 10.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.637 -179.734 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.9 -11.57 61.04 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.755 0.312 . . . . 0.0 111.423 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.589 ' CD1' HD13 ' A' ' 84' ' ' LEU . 55.0 m95 -85.9 158.18 19.99 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.118 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.8 mm100 -102.35 66.49 0.99 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.153 0.501 . . . . 0.0 110.819 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.568 HG23 ' O ' ' A' ' 31' ' ' THR . 11.4 t -160.43 106.73 1.52 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.104 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 13.4 m80 -62.05 93.34 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.122 -0.945 . . . . 0.0 111.59 -179.171 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.751 HD23 HG21 ' A' ' 53' ' ' ILE . 4.4 mp -48.87 153.46 0.85 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.219 178.832 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.433 HG22 ' OD1' ' A' ' 35' ' ' ASN . 6.8 mt -149.75 127.21 2.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 121.744 0.783 . . . . 0.0 112.121 -179.429 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.433 ' OD1' HG22 ' A' ' 34' ' ' ILE . 9.5 m120 65.26 50.85 0.85 Allowed Pre-proline 0 C--N 1.324 -0.517 0 CA-C-N 114.29 -1.323 . . . . 0.0 111.792 179.099 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.403 ' CD ' ' N ' ' A' ' 35' ' ' ASN . 21.7 Cg_endo -62.37 128.98 25.24 Favored 'Trans proline' 0 C--N 1.343 0.249 0 C-N-CA 121.997 1.798 . . . . 0.0 111.854 -179.46 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' HIS . . . . . 0.706 ' C ' HD12 ' A' ' 38' ' ' ILE . 19.5 t-160 -134.42 133.73 40.84 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.711 -0.396 . . . . 0.0 111.411 -179.785 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.706 HD12 ' C ' ' A' ' 37' ' ' HIS . 2.7 mp -126.17 131.09 71.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.666 179.619 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 25.1 mt -121.31 138.93 50.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.71 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.4 ' HB2' ' HB3' ' A' ' 6' ' ' SER . 10.0 mt -121.31 127.96 51.84 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.949 0.404 . . . . 0.0 110.811 179.868 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 8.5 m -125.59 -170.57 2.2 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.751 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.459 ' HA ' ' HA ' ' A' ' 47' ' ' PHE . 3.9 tttt -171.85 146.78 2.11 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.113 0.483 . . . . 0.0 110.794 -179.879 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.437 ' N ' ' HG2' ' A' ' 42' ' ' LYS . 7.2 mt-10 -131.45 169.57 13.45 Favored Pre-proline 0 C--N 1.324 -0.536 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.06 178.966 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' PRO . . . . . 0.426 ' HD2' ' HB3' ' A' ' 43' ' ' GLU . 69.1 Cg_exo -51.61 -19.96 8.32 Favored 'Trans proline' 0 N--CA 1.463 -0.307 0 C-N-CA 121.776 1.65 . . . . 0.0 112.23 -179.416 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -85.73 -76.71 0.32 Allowed 'General case' 0 N--CA 1.445 -0.708 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.309 179.379 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.452 ' HA3' ' HA ' ' A' ' 67' ' ' GLU . . . -142.99 -156.75 6.88 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.766 -179.336 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.459 ' HA ' ' HA ' ' A' ' 42' ' ' LYS . 22.3 m-85 -108.06 150.61 26.95 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-O 121.65 0.738 . . . . 0.0 112.57 -179.302 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.574 HG13 ' HG2' ' A' ' 65' ' ' LYS . 62.2 t -124.78 140.76 47.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 114.477 -1.238 . . . . 0.0 110.405 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -132.19 124.41 28.96 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.672 -0.24 . . . . 0.0 110.715 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -120.65 147.04 45.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.62 -0.264 . . . . 0.0 110.67 -179.862 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.676 ' N ' HD11 ' A' ' 76' ' ' LEU . . . -145.39 142.03 28.98 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.899 0.381 . . . . 0.0 111.433 179.738 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.457 HG23 HG22 ' A' ' 61' ' ' VAL . 3.9 m -136.02 131.67 35.28 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.101 -0.5 . . . . 0.0 109.99 179.419 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.751 HG21 HD23 ' A' ' 33' ' ' LEU . 22.0 mt -132.85 137.52 53.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 121.0 0.429 . . . . 0.0 111.344 -179.637 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -105.02 128.77 53.46 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.184 179.092 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.633 ' HB ' ' HD2' ' A' ' 56' ' ' PRO . 5.7 p -124.82 166.35 20.63 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.361 -179.895 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.633 ' HD2' ' HB ' ' A' ' 55' ' ' THR . 56.7 Cg_endo -72.79 -4.08 14.72 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.228 1.952 . . . . 0.0 112.529 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 81.1 m-20 -117.98 -4.3 11.08 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.406 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 154.1 -171.93 32.72 Favored Glycine 0 C--N 1.332 0.333 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.699 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.513 HG13 ' O ' ' A' ' 53' ' ' ILE . 21.4 t -127.33 142.69 42.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.739 0.304 . . . . 0.0 111.093 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.536 HD21 HD11 ' A' ' 87' ' ' LEU . 30.1 mt -119.37 152.36 36.93 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.323 -0.398 . . . . 0.0 111.315 -179.69 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.492 ' H ' HE22 ' A' ' 83' ' ' GLN . 21.6 t -141.56 143.61 27.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.815 179.735 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.411 ' O ' HD12 ' A' ' 76' ' ' LEU . . . -151.0 156.9 42.11 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.13 0.491 . . . . 0.0 111.545 -179.624 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 10.6 m -145.16 154.78 42.79 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.718 -179.326 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.754 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -148.91 100.78 0.21 Allowed Glycine 0 C--N 1.332 0.357 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.699 179.4 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.574 ' HG2' HG13 ' A' ' 48' ' ' VAL . 8.8 mttt -102.52 44.57 1.0 Allowed 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -178.838 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.62 ' ND1' HG21 ' A' ' 71' ' ' THR . 12.1 t-80 -76.36 155.3 34.23 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.78 0.324 . . . . 0.0 110.311 178.536 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.452 ' HA ' ' HA3' ' A' ' 46' ' ' GLY . 26.0 mt-10 -62.06 -26.22 68.14 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.759 0.314 . . . . 0.0 111.339 -179.871 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -97.28 121.95 39.76 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.044 0.449 . . . . 0.0 111.358 -179.395 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.6 ttt -47.51 -51.37 20.81 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.998 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 36.3 m-85 -65.91 -36.77 84.3 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.729 -179.023 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.62 HG21 ' ND1' ' A' ' 66' ' ' HIS . 94.2 m -64.23 -42.23 96.65 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.824 0.345 . . . . 0.0 110.658 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.754 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -61.51 -47.22 86.61 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.429 179.606 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.44 HG21 HG22 ' A' ' 19' ' ' VAL . 28.8 mt -59.71 -48.74 86.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.77 179.739 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 19.6 m-20 -64.03 -38.54 91.43 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.74 179.783 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -65.37 -45.66 83.22 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.606 179.726 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.676 HD11 ' N ' ' A' ' 51' ' ' ALA . 0.3 OUTLIER -54.22 -56.28 19.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.541 -0.3 . . . . 0.0 110.418 179.425 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.59 ' CG2' HD11 ' A' ' 26' ' ' LEU . 52.3 mt -57.86 -33.21 45.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 N-CA-C 110.227 -0.286 . . . . 0.0 110.227 179.231 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -58.63 -35.52 72.64 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.545 0.688 . . . . 0.0 109.781 178.641 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.4 mptp? -76.81 -27.77 55.31 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 114.83 -1.077 . . . . 0.0 110.138 179.409 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.509 HD12 ' HA ' ' A' ' 77' ' ' ILE . 96.3 mt -62.05 -50.14 73.19 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 177.472 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.462 ' HA ' HD12 ' A' ' 84' ' ' LEU . 2.5 tt0 -62.79 -46.25 88.86 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 114.277 -1.329 . . . . 0.0 110.709 177.869 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.69 -34.14 75.23 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.07 -179.588 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.492 HE22 ' H ' ' A' ' 61' ' ' VAL . 37.3 mt-30 -75.39 -36.08 60.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.586 179.713 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.637 ' HA ' HD12 ' A' ' 87' ' ' LEU . 4.3 mt -64.66 -27.68 69.09 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.83 179.869 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 20.8 t30 -64.17 -26.02 68.34 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.729 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.469 ' O ' ' CE1' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -72.71 -32.38 65.7 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.215 0.531 . . . . 0.0 110.85 -179.971 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.637 HD12 ' HA ' ' A' ' 84' ' ' LEU . 5.0 mt -68.23 -8.5 39.69 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.373 -0.83 . . . . 0.0 112.055 -179.394 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -74.87 -41.91 58.89 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.107 0.479 . . . . 0.0 111.103 -179.717 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.469 ' CE1' ' O ' ' A' ' 86' ' ' LYS . 4.0 p80 -85.17 -174.65 5.36 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.936 179.982 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.461 ' CB ' ' O ' ' A' ' 89' ' ' HIS . 11.9 tttt 86.28 146.4 0.06 Allowed 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.796 -179.756 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 141.25 109.9 0.8 Allowed Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.406 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -95.49 21.7 7.88 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.653 0.264 . . . . 0.0 111.198 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . 53.3 80.48 0.1 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.32 179.874 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -175.92 37.11 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.88 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 28.1 mtp85 -96.48 -32.76 12.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.922 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -95.92 80.28 3.32 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.098 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -82.84 -177.1 6.62 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.091 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -117.4 143.63 45.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.882 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.16 175.81 3.62 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.866 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.412 HG23 ' N ' ' A' ' 101' ' ' LYS . 4.2 m -131.31 -49.82 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.16 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.412 ' N ' HG23 ' A' ' 100' ' ' VAL . 3.0 tptt 179.94 38.93 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.831 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -144.41 117.08 8.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.902 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -173.97 87.08 0.05 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.062 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 31.9 m120 -119.55 -48.76 2.38 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.958 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 14.5 t80 -118.19 94.14 4.39 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.939 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 21.3 t -123.53 -60.53 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.093 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 60.71 110.17 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.888 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -122.2 -47.77 2.13 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.898 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 21.4 t -76.4 128.22 37.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.182 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -127.37 -68.12 0.8 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.863 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -150.88 92.45 1.83 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.91 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.243 -0.884 . . . . 0.0 110.929 179.958 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 1.2 m . . . . . 0 N--CA 1.486 1.36 0 CA-C-O 120.765 0.317 . . . . 0.0 111.213 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' MET . . . . . 0.688 ' HG3' HD11 ' A' ' 23' ' ' LEU . 5.9 tmm? -59.93 115.55 3.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.827 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -124.0 107.15 11.0 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.369 -179.704 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 40.0 mt -109.09 126.14 66.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.619 179.546 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -133.99 162.01 33.23 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.922 0.391 . . . . 0.0 111.147 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.422 ' HB3' ' HB2' ' A' ' 40' ' ' LEU . 21.6 p -162.72 137.58 6.69 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.298 -179.586 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.4 mmtt -101.82 34.65 2.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.116 -179.569 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -141.96 -45.3 0.34 Allowed 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.942 179.711 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.41 -177.81 4.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.84 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -106.8 163.95 12.51 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.435 179.817 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 3.8 mm -90.32 118.07 34.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 121.037 0.446 . . . . 0.0 111.009 -179.557 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.401 ' HB ' ' HD2' ' A' ' 13' ' ' PRO . 16.1 p -100.84 153.99 37.42 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.854 179.648 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.401 ' HD2' ' HB ' ' A' ' 12' ' ' THR . 15.2 Cg_endo -57.37 -27.33 75.15 Favored 'Trans proline' 0 C--N 1.343 0.289 0 C-N-CA 122.417 2.078 . . . . 0.0 111.904 179.306 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -74.82 -40.41 61.08 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.934 0.397 . . . . 0.0 110.518 179.665 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 26.0 mt -73.14 -31.05 33.28 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 178.897 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.92 -46.24 58.36 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.399 178.73 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -67.61 -35.15 78.4 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.306 178.89 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.44 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 52.6 t60 -58.29 -63.56 1.22 Allowed 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 178.671 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.641 HG12 HD21 ' A' ' 23' ' ' LEU . 28.6 t -61.41 -42.9 95.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.528 -0.305 . . . . 0.0 110.258 178.58 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.646 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -56.62 -46.13 81.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.46 179.401 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.44 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 1.2 p30 -60.02 -31.88 70.36 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 120.923 0.392 . . . . 0.0 110.546 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 36.1 mmt180 -73.23 -27.11 61.41 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.613 179.66 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.688 HD11 ' HG3' ' A' ' 2' ' ' MET . 2.0 mt -68.78 -49.82 55.47 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.118 0.485 . . . . 0.0 109.994 178.966 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.21 -26.42 66.36 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.016 179.459 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 19.8 tttt -77.22 -32.74 56.1 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.726 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.749 HD11 ' CG2' ' A' ' 77' ' ' ILE . 5.1 mt -80.73 53.84 1.99 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.845 0.355 . . . . 0.0 110.623 179.234 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -111.71 -11.14 14.02 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.083 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.96 -17.38 24.15 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.891 0.377 . . . . 0.0 111.058 179.742 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.915 ' CG ' HD13 ' A' ' 84' ' ' LEU . 63.2 m95 -84.03 -159.18 0.37 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.885 -179.74 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -133.6 -103.18 0.25 Allowed 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 178.783 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.418 ' O ' ' HB2' ' A' ' 32' ' ' HIS . 0.0 OUTLIER -83.39 -166.21 1.31 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.951 0.405 . . . . 0.0 111.263 179.504 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 32' ' ' HIS . . . . . 0.591 ' NE2' HD21 ' A' ' 87' ' ' LEU . 0.4 OUTLIER 73.32 51.75 0.13 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.822 179.42 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.456 HD23 ' HA ' ' A' ' 33' ' ' LEU . 13.4 mt -162.68 100.48 1.02 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.66 178.941 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.715 HG22 ' OD1' ' A' ' 35' ' ' ASN . 8.8 mt -151.98 124.58 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 121.386 0.612 . . . . 0.0 111.669 -179.867 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.715 ' OD1' HG22 ' A' ' 34' ' ' ILE . 1.8 m-20 68.56 67.91 0.49 Allowed Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.15 179.564 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -74.14 133.75 18.41 Favored 'Trans proline' 0 N--CA 1.463 -0.268 0 C-N-CA 122.172 1.915 . . . . 0.0 112.279 -179.426 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' HIS . . . . . 0.665 ' C ' HD12 ' A' ' 38' ' ' ILE . 2.1 t-160 -133.95 133.71 41.7 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 121.053 -0.259 . . . . 0.0 110.492 179.634 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.665 HD12 ' C ' ' A' ' 37' ' ' HIS . 3.1 mp -129.43 129.52 67.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.895 0.379 . . . . 0.0 111.155 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.572 ' C ' HD22 ' A' ' 40' ' ' LEU . 3.9 mp -118.09 140.47 41.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.404 179.511 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.572 HD22 ' C ' ' A' ' 39' ' ' ILE . 3.5 mm? -117.91 126.66 52.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.951 0.405 . . . . 0.0 111.161 -179.636 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -123.68 -172.88 2.62 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.379 179.638 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.456 ' CE ' ' CE2' ' A' ' 47' ' ' PHE . 13.4 tttm -172.95 146.73 1.56 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.197 0.522 . . . . 0.0 111.003 -179.803 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.427 ' HB3' ' HD2' ' A' ' 44' ' ' PRO . 43.7 mt-10 -132.33 166.79 26.12 Favored Pre-proline 0 C--N 1.323 -0.583 0 CA-C-N 115.428 -0.805 . . . . 0.0 109.153 179.054 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' PRO . . . . . 0.427 ' HD2' ' HB3' ' A' ' 43' ' ' GLU . 73.7 Cg_exo -50.05 -19.75 4.45 Favored 'Trans proline' 0 N--CA 1.464 -0.236 0 C-N-CA 121.678 1.586 . . . . 0.0 112.365 -179.529 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.75 -76.25 0.34 Allowed 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 115.575 -0.738 . . . . 0.0 110.328 179.317 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.452 ' HA3' ' HA ' ' A' ' 67' ' ' GLU . . . -142.72 -158.74 7.66 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.751 -179.301 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.456 ' CE2' ' CE ' ' A' ' 42' ' ' LYS . 24.2 m-85 -107.35 151.19 25.83 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 121.577 0.703 . . . . 0.0 112.433 -179.298 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.59 HG22 ' CB ' ' A' ' 65' ' ' LYS . 78.7 t -126.0 139.78 50.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 114.712 -1.131 . . . . 0.0 110.577 -179.881 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.443 ' O ' ' HA ' ' A' ' 63' ' ' SER . . . -131.03 124.44 30.88 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.642 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -120.07 148.66 43.31 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.694 0.283 . . . . 0.0 110.737 -179.969 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.802 ' CB ' HD11 ' A' ' 76' ' ' LEU . . . -145.11 142.08 29.36 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.976 0.417 . . . . 0.0 111.399 179.925 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 4.0 m -133.84 132.03 39.92 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.78 179.466 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.588 ' O ' HG13 ' A' ' 59' ' ' VAL . 13.2 mt -133.81 136.78 53.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.996 0.426 . . . . 0.0 111.516 -179.377 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.4 ' O ' ' HB ' ' A' ' 34' ' ' ILE . 3.3 m-80 -100.83 144.32 29.93 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.54 179.011 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.46 ' HB ' ' HA ' ' A' ' 32' ' ' HIS . 24.4 p -136.3 168.68 16.08 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.735 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.461 ' HG3' HD11 ' A' ' 34' ' ' ILE . 10.4 Cg_exo -71.84 -12.98 29.15 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.843 2.362 . . . . 0.0 112.705 -179.858 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -130.15 21.36 5.3 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 112.038 0.384 . . . . 0.0 112.038 -179.368 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 150.52 -164.79 29.9 Favored Glycine 0 C--N 1.33 0.223 0 C-N-CA 120.082 -1.056 . . . . 0.0 113.334 179.682 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.588 HG13 ' O ' ' A' ' 53' ' ' ILE . 12.8 t -141.7 146.55 22.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.687 0.279 . . . . 0.0 110.921 -179.868 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.568 HD22 ' HB3' ' A' ' 83' ' ' GLN . 2.8 mt -119.11 147.44 44.16 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.871 0.367 . . . . 0.0 111.271 -179.679 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 9.2 p -141.18 147.37 22.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.018 179.898 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.616 ' O ' HD12 ' A' ' 76' ' ' LEU . . . -155.23 154.41 32.15 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.078 0.466 . . . . 0.0 111.333 -179.954 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' SER . . . . . 0.443 ' HA ' ' O ' ' A' ' 49' ' ' ALA . 3.1 p -146.56 153.99 41.0 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.737 -179.41 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.755 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -147.47 107.03 0.37 Allowed Glycine 0 C--N 1.333 0.386 0 N-CA-C 111.496 -0.642 . . . . 0.0 111.496 179.199 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.59 ' CB ' HG22 ' A' ' 48' ' ' VAL . 13.6 mtpt -107.24 44.75 1.04 Allowed 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 -178.701 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.617 ' ND1' HG21 ' A' ' 71' ' ' THR . 12.8 t-80 -76.77 155.65 32.97 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.81 0.338 . . . . 0.0 110.292 178.688 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.452 ' HA ' ' HA3' ' A' ' 46' ' ' GLY . 1.3 mm-40 -61.64 -26.29 67.91 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.823 0.344 . . . . 0.0 111.185 179.819 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -98.09 123.69 42.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.367 -179.558 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 6.1 ttt -47.63 -47.43 29.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.773 -0.648 . . . . 0.0 111.796 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -66.46 -38.71 87.95 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.861 -179.016 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.617 HG21 ' ND1' ' A' ' 66' ' ' HIS . 87.8 m -63.84 -42.01 97.69 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.707 0.289 . . . . 0.0 110.76 -179.749 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.755 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -61.64 -49.0 78.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.541 179.678 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.525 HG21 HG22 ' A' ' 19' ' ' VAL . 23.1 mt -59.91 -47.54 91.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.788 179.715 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -63.39 -37.74 88.44 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.604 179.814 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -65.64 -44.1 87.46 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.575 179.57 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.802 HD11 ' CB ' ' A' ' 51' ' ' ALA . 0.3 OUTLIER -54.49 -56.8 15.1 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.269 179.323 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.749 ' CG2' HD11 ' A' ' 26' ' ' LEU . 14.1 mm -57.66 -30.31 36.78 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.493 -0.322 . . . . 0.0 110.133 179.044 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -58.32 -36.32 73.2 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.474 0.654 . . . . 0.0 109.694 178.534 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.6 ' HB2' ' HB1' ' A' ' 62' ' ' ALA . 5.7 mmtm -76.29 -30.06 57.61 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.853 -1.067 . . . . 0.0 110.375 179.365 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.559 HD22 HD12 ' A' ' 53' ' ' ILE . 31.4 mt -60.33 -49.68 76.62 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 177.477 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -61.44 -43.16 99.36 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 114.207 -1.361 . . . . 0.0 110.091 177.278 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.42 -30.6 71.34 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.55 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.568 ' HB3' HD22 ' A' ' 60' ' ' LEU . 34.2 mt-30 -76.35 -40.21 51.85 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.015 0.436 . . . . 0.0 110.48 179.486 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.915 HD13 ' CG ' ' A' ' 29' ' ' TRP . 6.5 mt -64.98 -30.76 71.77 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.646 179.684 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 -64.3 -52.66 57.45 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.551 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.437 ' HA ' ' CE1' ' A' ' 89' ' ' HIS . 6.9 mmtm -71.41 -21.17 62.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.48 179.52 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.592 ' C ' HD13 ' A' ' 87' ' ' LEU . 2.3 tm? -69.77 -30.72 68.36 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.644 179.701 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -76.13 -12.88 60.19 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.555 -179.746 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.437 ' CE1' ' HA ' ' A' ' 86' ' ' LYS . 6.7 m170 -85.17 -55.54 3.99 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.861 0.363 . . . . 0.0 110.959 179.812 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -70.34 65.76 0.29 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.947 -179.726 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 146.54 119.08 1.15 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.72 -0.753 . . . . 0.0 112.395 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -87.77 54.19 3.03 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.884 0.373 . . . . 0.0 111.0 -179.911 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . 59.72 168.92 0.07 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.27 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 8.1 ttt180 -103.03 160.76 14.34 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.86 179.899 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 1.1 tpt180 -102.88 -179.86 4.08 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.853 -179.941 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -72.99 -32.8 65.4 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.046 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -159.36 -45.07 0.05 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.131 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 60.55 167.54 0.08 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.832 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 4.8 t 60.94 -177.32 0.11 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.881 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.423 HG22 ' N ' ' A' ' 101' ' ' LYS . 9.4 p -131.59 154.7 40.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.085 179.92 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.423 ' N ' HG22 ' A' ' 100' ' ' VAL . 7.3 mttp -97.88 -48.35 5.21 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.811 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -139.33 -65.36 0.48 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.914 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -171.74 -55.34 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.019 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 -154.07 -64.86 0.14 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.951 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -68.96 105.62 2.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.889 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.529 ' O ' HG23 ' A' ' 106' ' ' VAL . 27.2 m -104.62 115.35 46.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.195 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -117.95 169.68 9.45 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.845 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -135.59 -47.34 0.68 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.866 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 30.1 t -126.04 143.27 40.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.055 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -117.96 98.36 6.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.817 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -103.49 130.08 50.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.884 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.168 -0.92 . . . . 0.0 110.908 179.982 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 1.3 p . . . . . 0 N--CA 1.485 1.317 0 CA-C-O 120.82 0.343 . . . . 0.0 111.087 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' MET . . . . . 0.859 ' HE1' HD11 ' A' ' 4' ' ' ILE . 8.4 tmm? -66.24 110.79 3.16 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.886 -179.87 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -103.0 124.87 49.33 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.19 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.859 HD11 ' HE1' ' A' ' 2' ' ' MET . 34.5 mt -109.89 124.01 66.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.873 179.786 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.8 p -134.09 156.7 47.81 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.059 179.741 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 22.0 p -164.37 139.79 5.89 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.614 -179.754 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 6.2 mtmp? -101.55 35.5 2.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.809 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -141.94 -50.23 0.39 Allowed 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.755 179.823 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 17.5 mtm -119.01 177.9 4.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.857 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 -104.52 164.96 11.38 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.736 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.482 HG22 ' HG3' ' A' ' 16' ' ' ARG . 4.8 mm -90.02 112.35 24.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 121.088 0.471 . . . . 0.0 111.009 -179.678 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.41 ' H ' HD12 ' A' ' 15' ' ' ILE . 19.3 p -98.92 148.69 34.91 Favored Pre-proline 0 C--N 1.326 -0.419 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.018 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_exo -55.3 -21.06 27.53 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.325 2.017 . . . . 0.0 111.69 179.148 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -76.12 -42.81 45.82 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.051 0.453 . . . . 0.0 110.317 179.255 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.622 ' O ' HG23 ' A' ' 19' ' ' VAL . 24.6 mt -72.41 -29.02 29.92 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.34 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.489 178.985 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.482 ' HG3' HG22 ' A' ' 11' ' ' ILE . 79.4 mtt180 -74.67 -45.19 46.19 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.575 -0.739 . . . . 0.0 109.74 178.773 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 3.3 tm0? -67.38 -38.89 85.44 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.564 179.022 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.487 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 78.3 t60 -59.75 -60.58 3.61 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 178.975 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.622 HG23 ' O ' ' A' ' 15' ' ' ILE . 15.1 t -60.45 -46.94 94.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 C-N-CA 121.014 -0.274 . . . . 0.0 110.31 178.733 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.69 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -58.1 -41.58 83.81 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.887 179.7 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.487 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 0.9 OUTLIER -59.59 -34.37 72.64 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.006 0.431 . . . . 0.0 110.064 179.9 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 9.0 mmt180 -74.81 -25.98 59.41 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.747 179.551 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.69 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 10.1 mt -68.85 -57.41 5.59 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.285 0.564 . . . . 0.0 110.521 179.388 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.15 -25.76 65.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.291 -0.868 . . . . 0.0 111.566 -179.777 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 10.1 tppt? -78.64 -32.57 47.37 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.039 0.447 . . . . 0.0 110.29 179.674 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.466 ' CD2' ' CD1' ' A' ' 29' ' ' TRP . 44.4 mt -80.15 63.81 4.77 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.836 -179.957 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -64.8 -42.44 95.02 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.959 -179.534 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.428 ' HG2' ' NE1' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -89.02 39.61 0.94 Allowed 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 120.839 0.352 . . . . 0.0 111.592 -179.472 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.644 ' HB3' HD13 ' A' ' 84' ' ' LEU . 27.1 m95 -148.26 -77.77 0.16 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.763 -179.242 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.517 ' NE2' HD22 ' A' ' 23' ' ' LEU . 18.5 mt-30 -65.22 102.27 0.63 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.708 0.289 . . . . 0.0 110.58 -179.907 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -159.01 -43.9 0.06 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.976 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -94.17 28.56 2.45 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.849 179.771 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.994 HD22 HG21 ' A' ' 53' ' ' ILE . 35.3 mt -102.99 156.43 17.68 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.422 179.743 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 28.9 mt -140.34 95.81 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 120.803 0.335 . . . . 0.0 111.498 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 59.74 70.15 1.12 Allowed Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.272 179.746 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.514 ' HB3' HG23 ' A' ' 53' ' ' ILE . 72.4 Cg_endo -73.9 163.83 36.05 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.557 2.171 . . . . 0.0 111.896 179.463 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' HIS . . . . . 0.497 ' O ' HD13 ' A' ' 38' ' ' ILE . 1.5 t-160 -137.36 131.11 31.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.043 0.449 . . . . 0.0 111.369 -179.596 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.709 HD12 ' CB ' ' A' ' 51' ' ' ALA . 8.5 mm -121.0 134.31 64.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.703 179.766 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.42 ' O ' HD23 ' A' ' 40' ' ' LEU . 23.3 mt -120.85 142.27 37.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.026 -179.853 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.42 HD23 ' O ' ' A' ' 39' ' ' ILE . 10.3 mt -121.29 128.31 52.21 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.78 -179.973 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.3 m -124.65 -171.53 2.37 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.492 179.813 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.408 ' HG3' ' CD2' ' A' ' 47' ' ' PHE . 7.5 ttpp -160.41 141.18 11.88 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.339 0.59 . . . . 0.0 111.353 -179.739 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -131.49 157.47 78.04 Favored Pre-proline 0 C--N 1.322 -0.593 0 CA-C-N 115.089 -0.959 . . . . 0.0 109.27 179.25 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_exo -52.41 -24.49 21.8 Favored 'Trans proline' 0 N--CA 1.464 -0.235 0 C-N-CA 121.808 1.672 . . . . 0.0 112.371 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -89.48 -6.83 56.1 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.433 -0.803 . . . . 0.0 112.766 -179.081 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 150.12 -163.87 29.55 Favored Glycine 0 C--O 1.224 -0.493 0 C-N-CA 120.239 -0.982 . . . . 0.0 112.16 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.408 ' CD2' ' HG3' ' A' ' 42' ' ' LYS . 18.7 m-85 -109.19 154.02 22.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.529 0.68 . . . . 0.0 111.959 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.563 HG22 ' CB ' ' A' ' 65' ' ' LYS . 74.6 t -127.72 139.73 51.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 114.858 -1.065 . . . . 0.0 111.042 -179.204 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -130.94 122.83 27.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.38 179.481 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -118.64 149.48 41.32 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.709 0.29 . . . . 0.0 110.807 -179.813 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.709 ' CB ' HD12 ' A' ' 38' ' ' ILE . . . -144.31 139.38 28.52 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.234 179.787 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.7 m -133.78 131.44 39.33 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 179.393 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.994 HG21 HD22 ' A' ' 33' ' ' LEU . 19.0 mt -133.05 136.6 55.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 121.146 0.498 . . . . 0.0 111.729 -179.226 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -101.79 119.06 38.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.688 179.38 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.728 HG22 HD23 ' A' ' 33' ' ' LEU . 9.3 p -112.46 155.89 43.06 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.529 179.717 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -63.01 -14.08 39.24 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.521 2.148 . . . . 0.0 112.576 -179.806 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 61.8 m-80 -120.38 22.23 11.38 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 111.709 0.262 . . . . 0.0 111.709 -179.605 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 139.33 -167.14 25.32 Favored Glycine 0 N--CA 1.453 -0.212 0 C-N-CA 120.446 -0.883 . . . . 0.0 112.85 179.707 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.706 HG13 ' O ' ' A' ' 53' ' ' ILE . 16.6 t -137.59 142.33 36.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.82 0.343 . . . . 0.0 111.04 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.598 HD12 ' C ' ' A' ' 59' ' ' VAL . 7.6 mp -116.34 153.54 31.81 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.104 -179.84 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 21.6 t -140.26 147.15 23.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.067 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -153.77 151.69 29.86 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.023 0.439 . . . . 0.0 111.576 -179.881 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -145.18 155.24 43.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.664 -179.342 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.698 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -148.67 104.53 0.28 Allowed Glycine 0 C--N 1.333 0.367 0 N-CA-C 111.399 -0.681 . . . . 0.0 111.399 179.32 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.563 ' CB ' HG22 ' A' ' 48' ' ' VAL . 10.7 mttm -106.87 45.5 0.98 Allowed 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -178.604 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.535 ' ND1' HG21 ' A' ' 71' ' ' THR . 14.6 t-80 -75.47 156.26 35.4 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 178.474 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -59.97 -27.56 66.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.752 0.311 . . . . 0.0 111.218 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -97.97 119.89 37.41 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.985 0.421 . . . . 0.0 111.475 -179.343 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.437 ' HE1' HD13 ' A' ' 15' ' ' ILE . 1.2 ttt -47.73 -46.27 29.71 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.502 179.732 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 45.6 m-85 -66.57 -39.51 88.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.127 -179.556 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.535 HG21 ' ND1' ' A' ' 66' ' ' HIS . 92.4 m -65.42 -38.56 90.27 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.668 179.87 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.698 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -62.03 -50.64 71.23 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.825 179.772 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.459 HG21 HG22 ' A' ' 19' ' ' VAL . 7.3 mt -61.34 -42.01 92.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.698 0.285 . . . . 0.0 110.249 179.518 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.3 t30 -64.53 -40.74 96.17 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.13 0.491 . . . . 0.0 109.965 178.862 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -65.41 -44.58 87.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.57 179.438 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.607 HD11 ' N ' ' A' ' 51' ' ' ALA . 0.3 OUTLIER -52.38 -59.91 3.85 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 179.119 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.573 HD13 HD12 ' A' ' 80' ' ' LEU . 1.9 mm -55.92 -28.7 24.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 178.503 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.52 -41.69 90.55 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.395 0.617 . . . . 0.0 109.433 178.243 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.32 -30.87 65.17 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.987 -1.006 . . . . 0.0 110.191 178.898 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.624 ' O ' HD12 ' A' ' 84' ' ' LEU . 96.9 mt -62.74 -46.51 87.72 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 177.43 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.27 -45.7 92.4 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 114.674 -1.148 . . . . 0.0 110.253 177.556 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.97 -35.71 81.59 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.529 -179.528 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -73.65 -46.87 44.08 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.893 0.378 . . . . 0.0 110.361 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.644 HD13 ' HB3' ' A' ' 29' ' ' TRP . 1.5 mt -64.69 -27.67 69.08 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.405 179.387 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ASN . . . . . 0.433 ' O ' ' HG3' ' A' ' 88' ' ' GLN . 54.7 t30 -61.15 -46.98 88.32 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.151 -179.575 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.455 ' HA ' ' CE1' ' A' ' 89' ' ' HIS . 5.4 mtmm -75.7 -24.04 56.2 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.976 179.649 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.802 HD23 ' O ' ' A' ' 87' ' ' LEU . 3.2 tt -72.38 -12.84 61.29 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.161 -0.472 . . . . 0.0 112.092 -179.394 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.433 ' HG3' ' O ' ' A' ' 85' ' ' ASN . 2.7 pp0? -76.02 -45.2 35.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.921 0.391 . . . . 0.0 111.925 -179.088 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.455 ' CE1' ' HA ' ' A' ' 86' ' ' LYS . 1.6 p-80 -87.85 164.43 15.9 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.234 -179.913 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -170.33 -43.87 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.95 179.652 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 171.03 -162.76 35.69 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.451 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 60.98 95.92 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.847 0.356 . . . . 0.0 110.929 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . 62.65 122.49 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.122 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 12.8 ptp180 -59.79 -31.99 70.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.87 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -69.88 131.36 44.32 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.806 -179.975 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -67.17 113.39 5.08 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.193 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -78.48 153.62 31.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.109 -179.902 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' THR . . . . . 0.419 HG22 ' N ' ' A' ' 99' ' ' SER . 18.7 m 60.33 163.06 0.06 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.903 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' SER . . . . . 0.419 ' N ' HG22 ' A' ' 98' ' ' THR . 0.3 OUTLIER 60.39 -173.41 0.12 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.916 -179.95 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 21.5 t 63.15 146.65 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.156 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 1.3 mtpt -155.91 173.55 16.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.945 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -126.25 89.26 2.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.884 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -69.11 -176.37 0.88 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.131 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 21.0 t30 60.44 168.02 0.08 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.905 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 36.4 p90 -110.71 118.29 35.77 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.896 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.436 HG22 ' N ' ' A' ' 107' ' ' GLU . 9.8 p -124.99 155.73 33.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.056 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 107' ' ' GLU . . . . . 0.436 ' N ' HG22 ' A' ' 106' ' ' VAL . 0.0 OUTLIER -69.31 124.47 23.93 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.872 179.891 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -152.18 35.99 0.53 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.842 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.556 HG13 ' O ' ' A' ' 109' ' ' VAL . 11.4 p -124.3 114.23 40.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.087 179.981 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -110.73 153.19 25.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.879 -179.981 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 27.3 mt-10 -104.48 176.63 5.09 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.882 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.294 -0.86 . . . . 0.0 110.865 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.487 1.402 0 CA-C-O 120.856 0.36 . . . . 0.0 111.193 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' MET . . . . . 0.769 ' HG3' HD11 ' A' ' 23' ' ' LEU . 6.1 tmm? -55.42 121.07 8.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.909 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -120.34 124.38 45.41 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.165 -179.863 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 49.2 mt -120.39 125.95 74.72 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.849 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -132.87 160.66 36.33 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.986 179.729 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.405 ' HB3' ' HB2' ' A' ' 40' ' ' LEU . 21.9 p -163.35 142.02 8.14 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.745 -179.468 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.7 mmtm -103.92 16.15 26.98 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.353 -179.795 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 17.6 mt-30 -141.92 23.02 2.09 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 120.791 0.329 . . . . 0.0 111.031 179.785 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 176.46 -178.26 0.15 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.654 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -121.12 163.04 19.02 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.784 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 3.8 mm -91.18 118.19 35.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.937 0.398 . . . . 0.0 110.877 -179.748 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.493 ' H ' HD12 ' A' ' 15' ' ' ILE . 19.2 p -100.21 159.26 30.27 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.871 179.739 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.431 ' HA ' ' HG2' ' A' ' 16' ' ' ARG . 24.1 Cg_exo -62.58 -13.3 32.73 Favored 'Trans proline' 0 C--N 1.344 0.291 0 C-N-CA 122.611 2.207 . . . . 0.0 112.215 179.479 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -90.23 -38.59 13.33 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.025 0.441 . . . . 0.0 110.678 179.537 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.493 HD12 ' H ' ' A' ' 12' ' ' THR . 19.3 mt -72.89 -32.38 39.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.758 -0.656 . . . . 0.0 109.513 179.194 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.431 ' HG2' ' HA ' ' A' ' 13' ' ' PRO . 23.2 ptt180 -71.54 -45.73 61.53 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.538 178.86 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.41 ' N ' ' CG ' ' A' ' 16' ' ' ARG . 6.0 tp-100 -67.02 -35.85 80.82 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.492 179.014 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.453 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 68.0 t60 -58.3 -64.03 1.06 Allowed 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 178.682 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.946 HG13 HD11 ' A' ' 77' ' ' ILE . 15.2 t -61.43 -45.32 98.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.663 178.866 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.633 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -55.52 -49.28 73.04 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.678 179.751 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.453 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 3.0 p30 -59.13 -29.24 67.26 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.822 0.344 . . . . 0.0 110.641 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 41.8 mmt180 -74.77 -28.03 60.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.528 179.339 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.769 HD11 ' HG3' ' A' ' 2' ' ' MET . 1.3 mt -68.85 -48.55 63.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.964 0.412 . . . . 0.0 110.102 178.794 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.97 -26.25 65.86 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.793 179.473 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 15.6 tttp -78.51 -32.04 47.89 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.649 179.492 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.642 HD23 ' OE2' ' A' ' 81' ' ' GLU . 5.4 mt -80.31 57.13 2.69 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.713 179.695 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -103.25 -3.24 25.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.515 -179.811 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.412 ' HE3' ' CZ2' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -66.71 -14.11 62.13 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.84 0.353 . . . . 0.0 111.28 179.925 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.589 ' NE1' HD13 ' A' ' 84' ' ' LEU . 49.8 m95 -84.96 -51.9 6.37 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.019 0.437 . . . . 0.0 110.895 179.882 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 66.99 73.36 0.35 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.133 179.936 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 9.1 t -160.06 149.69 17.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.168 0.509 . . . . 0.0 111.009 179.737 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' HIS . . . . . 0.556 ' O ' HD23 ' A' ' 33' ' ' LEU . 51.1 m80 -53.22 160.61 1.05 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.484 -0.78 . . . . 0.0 112.321 -178.792 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.997 HD22 HG21 ' A' ' 53' ' ' ILE . 72.0 mt -155.4 49.86 0.55 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.07 -0.968 . . . . 0.0 109.357 179.564 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 2.9 mt -46.62 92.44 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 121.997 0.903 . . . . 0.0 112.783 -178.567 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 51.44 84.72 0.2 Allowed Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 113.795 -1.548 . . . . 0.0 113.8 177.556 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.725 ' HB3' HG23 ' A' ' 53' ' ' ILE . 94.5 Cg_endo -86.3 132.5 3.76 Favored 'Trans proline' 0 N--CA 1.454 -0.847 0 C-N-CA 122.686 2.257 . . . . 0.0 109.92 177.11 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' HIS . . . . . 0.568 ' C ' HD13 ' A' ' 38' ' ' ILE . 0.5 OUTLIER -98.63 130.47 45.15 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -177.877 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.626 HD12 ' HB1' ' A' ' 51' ' ' ALA . 5.5 mm -121.48 132.65 70.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.342 -0.844 . . . . 0.0 109.766 178.976 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 26.6 mt -119.96 148.08 23.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 121.0 0.428 . . . . 0.0 111.868 -179.232 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.405 ' HB2' ' HB3' ' A' ' 6' ' ' SER . 4.6 mt -123.38 127.18 48.1 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.629 179.59 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -124.8 -170.76 2.22 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.725 -179.889 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.459 ' HA ' ' HA ' ' A' ' 47' ' ' PHE . 1.6 tttp -170.5 145.05 2.53 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.304 0.574 . . . . 0.0 110.932 -179.786 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.456 ' N ' ' HG2' ' A' ' 42' ' ' LYS . 3.3 mm-40 -130.24 163.87 44.88 Favored Pre-proline 0 C--N 1.323 -0.576 0 CA-C-N 115.457 -0.792 . . . . 0.0 108.927 178.871 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' PRO . . . . . 0.422 ' HD2' ' HB3' ' A' ' 43' ' ' GLU . 5.0 Cg_endo -48.14 -21.96 3.32 Favored 'Trans proline' 0 N--CA 1.463 -0.287 0 C-N-CA 122.073 1.848 . . . . 0.0 112.166 -179.359 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -83.73 -75.15 0.34 Allowed 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.212 179.291 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.469 ' HA3' ' HA ' ' A' ' 67' ' ' GLU . . . -143.89 -156.67 6.88 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.814 -179.31 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.459 ' HA ' ' HA ' ' A' ' 42' ' ' LYS . 22.8 m-85 -107.69 151.38 25.75 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.654 0.74 . . . . 0.0 112.476 -179.32 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.545 HG13 ' HG2' ' A' ' 65' ' ' LYS . 78.6 t -124.46 140.93 46.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 114.525 -1.216 . . . . 0.0 110.424 -179.875 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.439 ' O ' ' HA ' ' A' ' 63' ' ' SER . . . -132.08 125.1 30.55 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.64 -0.255 . . . . 0.0 110.922 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 -117.77 148.58 41.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.465 179.652 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.728 ' HB2' HD21 ' A' ' 76' ' ' LEU . . . -144.58 142.52 30.23 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.968 0.413 . . . . 0.0 111.771 -179.802 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.1 m -135.26 131.32 36.45 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.839 179.334 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.997 HG21 HD22 ' A' ' 33' ' ' LEU . 21.3 mt -133.35 138.84 50.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.119 0.485 . . . . 0.0 111.842 -179.159 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 18.9 m120 -102.28 119.18 38.37 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.648 179.3 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.501 ' HB ' ' HD2' ' A' ' 56' ' ' PRO . 6.1 p -113.82 162.35 23.14 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.295 179.673 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.501 ' HD2' ' HB ' ' A' ' 55' ' ' THR . 68.9 Cg_endo -76.22 -3.17 13.49 Favored 'Trans proline' 0 N--CA 1.463 -0.318 0 C-N-CA 122.211 1.94 . . . . 0.0 112.517 -179.857 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -129.63 23.47 5.44 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.202 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 140.4 -167.4 25.52 Favored Glycine 0 C--N 1.33 0.239 0 C-N-CA 120.54 -0.838 . . . . 0.0 112.778 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 21.3 t -131.55 147.27 32.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.766 0.317 . . . . 0.0 111.11 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 13.0 mt -120.65 141.97 49.87 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.29 -179.767 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 21.7 t -141.21 139.96 32.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.758 179.74 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.539 ' HB1' ' HB2' ' A' ' 79' ' ' LYS . . . -151.42 159.5 44.2 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.296 0.569 . . . . 0.0 111.857 -179.557 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' SER . . . . . 0.439 ' HA ' ' O ' ' A' ' 49' ' ' ALA . 2.4 p -145.58 154.89 42.66 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.281 -0.872 . . . . 0.0 111.678 -179.306 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.715 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -148.31 105.05 0.3 Allowed Glycine 0 C--N 1.332 0.358 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.551 179.341 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.545 ' HG2' HG13 ' A' ' 48' ' ' VAL . 5.3 mttp -105.97 44.9 1.0 Allowed 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 112.401 0.519 . . . . 0.0 112.401 -178.683 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.634 ' ND1' HG21 ' A' ' 71' ' ' THR . 12.6 t-80 -76.64 155.69 33.26 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.757 0.313 . . . . 0.0 110.309 178.582 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.469 ' HA ' ' HA3' ' A' ' 46' ' ' GLY . 10.8 mt-10 -61.63 -26.34 67.94 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.787 0.327 . . . . 0.0 111.223 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -97.61 122.63 40.91 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.083 0.468 . . . . 0.0 111.475 -179.364 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.565 ' HE3' HD11 ' A' ' 73' ' ' ILE . 0.9 OUTLIER -47.71 -49.91 26.59 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.772 179.955 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 40.3 m-85 -66.19 -37.45 85.63 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.711 -179.087 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.634 HG21 ' ND1' ' A' ' 66' ' ' HIS . 94.1 m -64.22 -41.61 96.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.774 0.321 . . . . 0.0 110.655 -179.859 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.715 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -61.83 -47.91 82.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.491 179.455 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.565 HD11 ' HE3' ' A' ' 69' ' ' MET . 31.0 mt -60.19 -48.08 89.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.624 179.715 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -64.05 -39.78 94.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.752 179.767 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -65.12 -44.34 89.03 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.536 179.678 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.728 HD21 ' HB2' ' A' ' 51' ' ' ALA . 0.3 OUTLIER -54.21 -57.6 10.54 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.504 -0.317 . . . . 0.0 110.373 179.397 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.946 HD11 HG13 ' A' ' 19' ' ' VAL . 61.6 mt -56.63 -30.88 33.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 N-CA-C 110.162 -0.311 . . . . 0.0 110.162 179.218 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -58.66 -36.55 74.32 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.513 0.673 . . . . 0.0 109.571 178.403 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.539 ' HB2' ' HB1' ' A' ' 62' ' ' ALA . 0.0 OUTLIER -75.6 -28.04 58.75 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.8 -1.091 . . . . 0.0 110.024 179.258 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.639 ' O ' HD12 ' A' ' 84' ' ' LEU . 77.7 mt -62.79 -49.6 74.34 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 177.438 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.642 ' OE2' HD23 ' A' ' 26' ' ' LEU . 3.4 tt0 -62.68 -46.13 89.6 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 114.293 -1.321 . . . . 0.0 110.744 177.87 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.74 -37.53 86.93 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.939 -179.433 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 44.3 mt-30 -75.71 -37.7 59.2 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.884 0.373 . . . . 0.0 110.803 179.88 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.653 ' HA ' HD12 ' A' ' 87' ' ' LEU . 2.2 mt -64.24 -25.37 68.03 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.695 179.668 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -64.15 -28.0 69.46 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.538 179.661 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 16.2 mmtt -72.66 -22.37 60.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.102 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.653 HD12 ' HA ' ' A' ' 84' ' ' LEU . 9.9 mt -68.75 -53.89 19.21 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.873 0.368 . . . . 0.0 110.568 179.827 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 61.5 mt-30 -77.16 -8.84 58.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.094 179.581 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 7.2 m-70 58.57 177.71 0.07 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.033 179.91 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 2.0 mmmp? -169.6 -43.77 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.811 179.828 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -115.3 -32.12 1.88 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.518 179.953 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -121.13 136.56 54.95 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.804 0.335 . . . . 0.0 110.863 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -171.1 152.74 3.53 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.165 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.09 140.55 18.76 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.869 -179.952 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.58 143.97 25.99 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.868 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -93.36 -177.66 4.5 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.106 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -155.14 155.06 33.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.123 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -151.6 -68.17 0.17 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.917 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 19.8 m 63.2 124.01 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.97 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.639 HG22 ' O ' ' A' ' 100' ' ' VAL . 14.7 p -130.53 16.42 2.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.401 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 1.2 mmpt? 60.04 111.47 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.809 0.337 . . . . 0.0 110.959 179.808 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -157.52 106.84 2.14 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.905 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -138.61 -51.41 0.57 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.167 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 11.5 p30 -60.14 173.46 0.64 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.928 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.417 ' O ' HG12 ' A' ' 106' ' ' VAL . 17.2 m-85 -159.63 -177.96 6.75 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.854 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.574 HG22 ' O ' ' A' ' 106' ' ' VAL . 13.6 p 43.52 45.61 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.18 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.62 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 58.2 mt-10 -58.02 -29.3 65.22 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.089 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -60.46 168.66 2.02 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.922 179.932 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 11.2 p -150.92 136.99 12.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.067 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 7.7 tm-20 60.66 109.79 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.888 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -132.3 168.22 18.48 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.828 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.178 -0.915 . . . . 0.0 110.953 -179.989 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 85.9 m . . . . . 0 N--CA 1.486 1.365 0 CA-C-O 120.856 0.36 . . . . 0.0 111.216 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' MET . . . . . 0.493 ' CE ' ' HB2' ' A' ' 20' ' ' ALA . 3.2 mpp? -113.01 156.46 23.03 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.916 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.406 ' HB3' ' CD2' ' A' ' 37' ' ' HIS . 2.0 m-80 -122.91 114.27 20.22 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.26 -179.932 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 36.4 mt -123.55 123.86 68.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.68 179.617 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -134.99 157.5 46.78 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.998 0.428 . . . . 0.0 111.366 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 22.4 p -164.69 139.59 5.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.436 -179.761 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -102.03 25.31 8.9 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.188 -179.736 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -140.89 15.53 2.3 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.164 179.648 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER 173.72 -177.33 0.08 Allowed 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.984 0.421 . . . . 0.0 110.74 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -110.69 172.51 6.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.651 179.838 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.8 mm -91.01 113.22 26.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 121.009 0.433 . . . . 0.0 111.173 -179.579 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 12.5 p -98.83 157.39 34.24 Favored Pre-proline 0 C--N 1.327 -0.405 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.959 179.809 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.429 ' HA ' ' HG2' ' A' ' 16' ' ' ARG . 23.9 Cg_exo -62.55 -13.51 33.9 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.579 2.186 . . . . 0.0 111.984 179.204 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -86.1 -41.01 15.11 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.058 0.456 . . . . 0.0 110.428 179.397 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.702 ' O ' HG23 ' A' ' 19' ' ' VAL . 24.5 mt -72.7 -29.29 29.72 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.29 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.813 179.265 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.429 ' HG2' ' HA ' ' A' ' 13' ' ' PRO . 2.2 ptm180 -74.99 -43.4 54.15 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.868 -0.605 . . . . 0.0 109.544 178.935 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -67.39 -37.94 83.91 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.696 178.922 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.463 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 82.1 t60 -60.63 -53.65 54.86 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 178.55 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.798 ' O ' ' HG3' ' A' ' 22' ' ' ARG . 23.9 t -62.55 -49.28 84.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.209 178.312 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.551 ' HA ' ' CG ' ' A' ' 23' ' ' LEU . . . -55.65 -37.91 68.85 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.759 -0.376 . . . . 0.0 111.875 179.762 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.463 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 0.9 OUTLIER -64.37 -32.53 74.18 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.37 -0.532 . . . . 0.0 110.477 179.335 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.798 ' HG3' ' O ' ' A' ' 19' ' ' VAL . 0.0 OUTLIER -77.9 -39.72 42.14 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.914 -0.585 . . . . 0.0 112.486 -179.283 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.65 ' CD2' HG12 ' A' ' 19' ' ' VAL . 0.0 OUTLIER -65.24 -48.51 73.04 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 120.034 -0.666 . . . . 0.0 110.843 -179.463 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.31 -24.79 66.68 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.15 179.556 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 2.9 tppp? -79.14 -34.29 43.39 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.854 179.888 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.663 HD23 ' HE1' ' A' ' 29' ' ' TRP . 0.8 OUTLIER -81.22 56.97 3.02 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.908 -179.991 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -109.86 -12.28 14.6 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.513 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.437 ' HE3' ' CD2' ' A' ' 29' ' ' TRP . 0.2 OUTLIER -66.08 -14.11 61.18 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.735 0.302 . . . . 0.0 111.483 -179.922 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.663 ' HE1' HD23 ' A' ' 26' ' ' LEU . 66.1 m95 -84.92 165.02 17.99 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.095 -179.827 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.478 ' O ' HG22 ' A' ' 31' ' ' THR . 6.9 mp0 -84.2 -130.59 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.216 179.637 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.478 HG22 ' O ' ' A' ' 30' ' ' GLN . 15.3 t 45.0 -166.97 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.146 0 CA-C-O 120.836 0.35 . . . . 0.0 111.21 179.832 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' HIS . . . . . 0.608 ' C ' HD12 ' A' ' 33' ' ' LEU . 97.4 m-70 -144.38 -41.04 0.26 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.224 -179.73 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.608 HD12 ' C ' ' A' ' 32' ' ' HIS . 1.0 OUTLIER 66.15 147.63 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.203 -179.531 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.593 HG22 ' OD1' ' A' ' 35' ' ' ASN . 25.0 mt -138.47 111.07 6.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 121.335 0.588 . . . . 0.0 112.193 -179.604 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.593 ' OD1' HG22 ' A' ' 34' ' ' ILE . 25.1 m120 62.88 81.19 0.23 Allowed Pre-proline 0 C--N 1.327 -0.384 0 CA-C-N 115.091 -0.958 . . . . 0.0 112.312 178.96 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.403 ' HB3' HG23 ' A' ' 53' ' ' ILE . 69.4 Cg_endo -81.89 145.08 14.0 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.988 2.459 . . . . 0.0 111.433 178.71 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' HIS . . . . . 0.406 ' CD2' ' HB3' ' A' ' 3' ' ' ASN . 2.2 t-160 -134.4 130.97 37.65 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.125 0.488 . . . . 0.0 111.635 -179.455 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 9.1 mm -120.13 133.76 65.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.388 179.495 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 2.1 mp -119.11 146.26 24.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.002 -179.815 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 45.8 mt -124.13 126.85 46.88 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.888 179.909 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -123.65 -173.93 2.86 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.398 179.696 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.409 ' HG3' ' CD2' ' A' ' 47' ' ' PHE . 15.1 tttt -159.7 140.66 12.45 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.425 0.631 . . . . 0.0 111.489 -179.667 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -131.58 156.82 79.62 Favored Pre-proline 0 C--N 1.323 -0.566 0 CA-C-N 114.934 -1.03 . . . . 0.0 109.195 179.15 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_exo -52.12 -24.47 20.15 Favored 'Trans proline' 0 N--CA 1.465 -0.183 0 C-N-CA 121.854 1.703 . . . . 0.0 112.418 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -89.64 -6.71 55.93 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.499 -0.773 . . . . 0.0 112.833 -179.178 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 149.94 -164.35 29.57 Favored Glycine 0 C--O 1.224 -0.503 0 C-N-CA 120.214 -0.993 . . . . 0.0 112.154 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.41 ' CD1' ' N ' ' A' ' 47' ' ' PHE . 18.3 m-85 -108.35 153.63 22.99 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.57 0.7 . . . . 0.0 111.854 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.623 HG22 ' CG ' ' A' ' 65' ' ' LYS . 54.1 t -127.36 140.7 48.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 114.82 -1.082 . . . . 0.0 111.023 -179.281 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -131.84 124.11 28.92 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.677 179.682 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 67.8 m-20 -118.89 147.33 44.11 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.685 0.278 . . . . 0.0 110.743 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.6 ' CB ' HD11 ' A' ' 76' ' ' LEU . . . -144.97 141.19 28.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.875 0.369 . . . . 0.0 111.547 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.629 ' O ' HD13 ' A' ' 53' ' ' ILE . 6.4 m -135.29 133.49 38.94 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.361 179.576 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.648 ' O ' HG13 ' A' ' 59' ' ' VAL . 1.1 mm -132.31 134.38 59.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.843 0.354 . . . . 0.0 111.13 -179.825 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 23.7 m120 -103.24 118.29 36.45 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.438 179.026 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.444 HG22 ' HG ' ' A' ' 33' ' ' LEU . 30.3 p -113.61 153.98 45.73 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.877 179.93 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_exo -61.87 -15.46 43.02 Favored 'Trans proline' 0 C--N 1.343 0.263 0 C-N-CA 122.564 2.176 . . . . 0.0 112.655 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 6.6 m120 -118.89 21.98 12.17 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.616 -0.265 . . . . 0.0 111.691 -179.546 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 141.84 -165.46 26.52 Favored Glycine 0 C--N 1.33 0.243 0 C-N-CA 120.376 -0.916 . . . . 0.0 113.053 179.756 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.648 HG13 ' O ' ' A' ' 53' ' ' ILE . 12.5 t -142.24 142.29 27.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.822 0.344 . . . . 0.0 111.02 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -117.64 148.99 41.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.192 -179.792 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 12.4 t -138.87 145.6 27.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.874 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.479 ' O ' HD12 ' A' ' 76' ' ' LEU . . . -153.43 150.97 29.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.168 0.509 . . . . 0.0 111.604 -179.723 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 11.5 p -143.04 158.7 43.36 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.643 -179.41 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.56 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -153.46 109.77 0.42 Allowed Glycine 0 C--N 1.33 0.232 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.61 179.639 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.623 ' CG ' HG22 ' A' ' 48' ' ' VAL . 60.7 mttt -110.68 45.14 1.17 Allowed 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -178.954 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 12.3 t-80 -75.79 156.36 34.61 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 110.207 -0.294 . . . . 0.0 110.207 178.543 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -61.1 -26.7 67.84 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.72 0.295 . . . . 0.0 111.295 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -98.53 120.8 39.57 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.023 0.439 . . . . 0.0 111.371 -179.378 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 13.2 ttt -48.04 -50.72 26.94 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.953 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -65.56 -40.23 92.6 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.268 -179.296 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 37.9 m -64.74 -40.44 95.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.801 0.334 . . . . 0.0 110.679 179.891 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.56 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -62.17 -49.36 76.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.648 179.506 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 12.9 mt -60.4 -45.1 97.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.878 0.37 . . . . 0.0 110.266 179.512 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -64.45 -37.82 88.85 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.261 179.264 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -65.85 -42.23 90.71 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.183 179.233 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.6 HD11 ' CB ' ' A' ' 51' ' ' ALA . 0.3 OUTLIER -53.57 -56.24 18.78 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 178.4 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.54 HD13 ' CG ' ' A' ' 22' ' ' ARG . 37.4 mt -56.79 -30.63 33.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.17 178.493 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -57.93 -35.77 71.55 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.548 0.69 . . . . 0.0 109.305 178.241 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.3 mptp? -78.92 -31.27 45.16 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 114.7 -1.136 . . . . 0.0 110.208 179.065 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.501 HD12 ' HA ' ' A' ' 77' ' ' ILE . 76.4 mt -63.07 -50.39 70.76 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 177.775 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -60.46 -47.6 85.42 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 114.942 -1.027 . . . . 0.0 110.22 177.522 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 59.7 mtt180 -62.96 -24.57 67.95 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.819 179.97 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 7.2 mt-30 -75.44 -44.24 45.4 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.615 179.757 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.633 HD13 ' CG ' ' A' ' 29' ' ' TRP . 28.3 mt -64.79 -27.4 68.86 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.835 179.866 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -63.55 -33.06 74.76 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.018 0.437 . . . . 0.0 110.549 179.75 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 18.6 mmtt -73.31 -25.95 60.86 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.966 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.505 HD23 ' O ' ' A' ' 87' ' ' LEU . 3.3 tt -69.45 -16.62 63.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.196 179.992 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -76.52 -5.72 48.77 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.477 -179.9 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.433 ' O ' ' CB ' ' A' ' 90' ' ' LYS . 5.9 p80 -154.8 -177.04 6.23 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.729 0.299 . . . . 0.0 110.903 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.433 ' CB ' ' O ' ' A' ' 89' ' ' HIS . 1.2 ttpm? 83.41 89.46 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.829 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -75.87 -29.24 59.44 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.493 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 60.93 -177.89 0.11 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.826 0.346 . . . . 0.0 110.932 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -134.83 167.16 21.38 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.124 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -92.39 155.23 18.03 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.919 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 10.8 mtt-85 -135.62 -56.58 0.79 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.925 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -146.53 134.25 21.12 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.138 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -65.37 -56.07 14.61 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.099 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.8 133.36 35.26 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.882 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -177.56 -41.59 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.872 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 28.4 t -63.23 -67.16 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.12 -179.972 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 16.7 mttm -105.8 115.52 30.39 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.947 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -85.79 -172.74 4.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.859 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -134.55 -46.16 0.75 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.131 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -90.62 158.31 17.01 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.989 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.497 ' O ' HG22 ' A' ' 106' ' ' VAL . 0.1 OUTLIER 66.89 -73.21 0.08 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.952 -179.999 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.497 HG22 ' O ' ' A' ' 105' ' ' PHE . 21.5 m 45.13 -171.26 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.665 179.972 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -90.76 87.75 6.8 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.836 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -75.87 156.33 34.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.993 -179.882 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.484 HG12 ' HG3' ' A' ' 110' ' ' GLU . 26.0 t 67.68 -70.88 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.134 179.914 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 110' ' ' GLU . . . . . 0.484 ' HG3' HG12 ' A' ' 109' ' ' VAL . 0.0 OUTLIER 177.22 -44.36 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.803 179.986 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -175.78 175.39 2.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.852 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.167 -0.92 . . . . 0.0 110.893 -179.968 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 2.6 m . . . . . 0 N--CA 1.486 1.328 0 CA-C-O 120.773 0.321 . . . . 0.0 111.259 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' MET . . . . . 0.722 ' CE ' HD11 ' A' ' 4' ' ' ILE . 0.0 OUTLIER -58.05 170.93 0.59 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.054 -179.905 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -116.7 136.43 52.97 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.483 -179.497 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.722 HD11 ' CE ' ' A' ' 2' ' ' MET . 34.7 mt -126.27 125.39 67.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.408 179.386 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.455 ' OG1' HD13 ' A' ' 39' ' ' ILE . 2.9 p -134.35 161.2 35.65 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.869 0.366 . . . . 0.0 111.18 179.949 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 29.1 p -163.38 138.3 6.33 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.551 -179.45 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 20.3 mttt -101.74 31.48 3.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.931 -179.769 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -141.19 -47.48 0.39 Allowed 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.805 179.743 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 1.5 mpp? -120.37 -170.36 1.97 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.748 179.859 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -118.41 164.96 14.47 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.572 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.467 ' CD1' HG22 ' A' ' 4' ' ' ILE . 4.1 mm -89.95 115.1 28.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 121.073 0.463 . . . . 0.0 110.945 -179.576 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.546 ' H ' HD12 ' A' ' 15' ' ' ILE . 20.1 p -100.35 155.81 35.97 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.924 179.79 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_exo -59.56 -17.51 42.03 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.39 2.06 . . . . 0.0 111.822 179.147 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.01 -40.47 22.06 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-O 121.108 0.48 . . . . 0.0 110.226 179.21 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.546 HD12 ' H ' ' A' ' 12' ' ' THR . 19.1 mt -73.42 -28.72 25.88 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.594 179.019 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.57 -45.01 48.12 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.169 178.819 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 42.9 tt0 -67.74 -37.32 82.01 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.371 178.809 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.427 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 57.6 t60 -59.29 -60.02 4.53 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 178.648 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.544 HG23 ' O ' ' A' ' 15' ' ' ILE . 21.3 t -60.77 -45.36 97.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 110.142 -0.318 . . . . 0.0 110.142 178.396 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.681 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -57.65 -42.07 82.72 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.538 179.394 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.427 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 0.9 OUTLIER -59.67 -33.23 71.29 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 121.075 0.464 . . . . 0.0 110.043 179.607 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 19.8 mmm180 -74.15 -26.07 60.1 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.516 179.316 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.681 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 14.7 mt -66.44 -53.12 39.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.016 0.436 . . . . 0.0 109.942 178.988 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.77 -22.25 63.89 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.757 179.057 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 6.5 tptp -78.8 -28.08 44.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.15 179.191 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.592 HD22 ' CB ' ' A' ' 29' ' ' TRP . 33.5 mt -76.84 60.22 1.72 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.824 -179.844 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.16 -61.01 2.66 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.214 -179.785 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.445 ' HG2' ' NE1' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -90.03 39.72 0.97 Allowed 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.112 0.482 . . . . 0.0 110.672 179.675 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.653 ' HB3' HD13 ' A' ' 84' ' ' LEU . 23.4 m95 -147.87 -36.2 0.21 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.426 -178.776 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 14.3 tt0 -70.47 65.38 0.29 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.945 0.402 . . . . 0.0 110.278 179.478 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -78.26 -164.47 0.55 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.026 -179.471 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 94.7 m-70 -60.05 83.25 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.46 -179.599 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.738 HD22 HG21 ' A' ' 53' ' ' ILE . 37.3 mt -92.14 143.77 26.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.115 -0.493 . . . . 0.0 109.976 179.202 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.597 HG22 ' OD1' ' A' ' 35' ' ' ASN . 3.5 mp -138.51 114.95 10.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.858 0.837 . . . . 0.0 112.164 -179.931 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.597 ' OD1' HG22 ' A' ' 34' ' ' ILE . 12.7 m120 72.02 49.0 0.26 Allowed Pre-proline 0 C--N 1.327 -0.393 0 CA-C-N 114.144 -1.389 . . . . 0.0 111.726 179.183 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.457 ' HG2' ' HA ' ' A' ' 2' ' ' MET . 19.4 Cg_endo -62.29 125.64 16.77 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.08 1.854 . . . . 0.0 112.052 -179.36 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -140.11 126.95 20.63 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.549 -0.46 . . . . 0.0 111.865 -179.814 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.638 HD12 ' N ' ' A' ' 38' ' ' ILE . 3.4 mp -119.34 138.35 50.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.418 179.323 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.455 HD13 ' OG1' ' A' ' 5' ' ' THR . 22.1 mm -116.05 148.38 18.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.46 -179.485 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 11.0 mt -122.88 127.19 48.65 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.518 179.615 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 11.7 m -125.33 -171.16 2.31 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.789 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.46 ' HA ' ' HA ' ' A' ' 47' ' ' PHE . 5.2 ttpt -173.58 146.63 1.34 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.128 0.49 . . . . 0.0 110.765 -179.791 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.443 ' HB3' ' HD2' ' A' ' 44' ' ' PRO . 2.1 mt-10 -132.04 170.5 11.15 Favored Pre-proline 0 C--N 1.324 -0.506 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.299 179.228 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' PRO . . . . . 0.443 ' HD2' ' HB3' ' A' ' 43' ' ' GLU . 69.0 Cg_exo -51.45 -19.7 7.43 Favored 'Trans proline' 0 N--CA 1.464 -0.241 0 C-N-CA 121.727 1.618 . . . . 0.0 112.302 -179.502 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.12 -77.95 0.29 Allowed 'General case' 0 N--CA 1.445 -0.724 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.104 179.344 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.452 ' HA3' ' HA ' ' A' ' 67' ' ' GLU . . . -141.77 -155.68 6.55 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.859 -179.309 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.46 ' HA ' ' HA ' ' A' ' 42' ' ' LYS . 21.9 m-85 -108.94 151.13 26.72 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-O 121.639 0.733 . . . . 0.0 112.699 -179.232 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.519 HG22 ' CB ' ' A' ' 65' ' ' LYS . 75.7 t -124.98 141.45 45.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 114.482 -1.236 . . . . 0.0 110.517 -179.659 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.402 ' O ' ' HA ' ' A' ' 63' ' ' SER . . . -132.44 124.09 27.94 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.654 -0.248 . . . . 0.0 110.797 179.787 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 21.2 m-20 -119.04 149.19 42.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.602 -0.272 . . . . 0.0 110.547 179.858 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.467 ' N ' HD11 ' A' ' 76' ' ' LEU . . . -146.69 140.42 25.92 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.829 0.347 . . . . 0.0 111.317 179.849 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.6 m -135.12 131.56 37.02 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.033 179.402 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.738 HG21 HD22 ' A' ' 33' ' ' LEU . 17.4 mt -133.33 136.4 54.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 121.013 0.435 . . . . 0.0 111.456 -179.547 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -103.6 131.28 50.88 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.148 178.963 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.573 ' HB ' ' HD2' ' A' ' 56' ' ' PRO . 5.8 p -127.83 163.33 43.98 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.444 -179.904 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.573 ' HD2' ' HB ' ' A' ' 55' ' ' THR . 53.6 Cg_endo -70.83 -5.67 17.41 Favored 'Trans proline' 0 C--N 1.343 0.25 0 C-N-CA 122.321 2.014 . . . . 0.0 112.687 179.921 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 67.7 m-80 -124.82 22.12 8.19 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.685 -0.234 . . . . 0.0 111.379 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 133.68 -167.76 23.46 Favored Glycine 0 C--N 1.33 0.212 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.784 179.774 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.675 HG13 ' O ' ' A' ' 53' ' ' ILE . 14.1 t -137.24 144.7 31.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 120.665 0.269 . . . . 0.0 111.008 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.567 HD22 ' HG ' ' A' ' 84' ' ' LEU . 3.7 mp -119.34 152.4 36.82 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.108 -179.97 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.435 ' O ' ' NE2' ' A' ' 83' ' ' GLN . 9.3 p -143.0 145.36 22.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.866 179.7 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -152.01 156.82 40.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.054 0.454 . . . . 0.0 111.814 -179.652 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' SER . . . . . 0.438 ' HA ' HD12 ' A' ' 76' ' ' LEU . 4.0 m -145.04 156.05 43.71 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.858 -179.155 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.606 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -150.15 105.38 0.29 Allowed Glycine 0 CA--C 1.519 0.324 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.445 179.355 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.519 ' CB ' HG22 ' A' ' 48' ' ' VAL . 2.1 mtpp -108.68 45.9 1.0 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.57 0.581 . . . . 0.0 112.57 -178.618 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.605 ' ND1' HG21 ' A' ' 71' ' ' THR . 12.8 t-80 -76.73 156.52 32.4 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.795 0.331 . . . . 0.0 110.28 178.547 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.452 ' HA ' ' HA3' ' A' ' 46' ' ' GLY . 2.0 pt-20 -61.89 -26.98 68.48 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.798 0.333 . . . . 0.0 111.3 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -97.68 123.12 41.47 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.106 0.479 . . . . 0.0 111.564 -179.313 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 26.0 ttt -48.35 -49.14 35.51 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.693 179.852 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 -66.32 -38.78 88.47 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.466 -179.211 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.605 HG21 ' ND1' ' A' ' 66' ' ' HIS . 84.7 m -64.53 -41.51 96.33 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.719 -179.889 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.606 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -61.78 -48.7 79.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.646 179.599 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 25.4 mt -60.34 -46.85 94.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 120.891 0.377 . . . . 0.0 110.564 179.647 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -64.16 -39.2 93.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.615 179.558 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -65.46 -47.4 76.27 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.363 179.533 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.467 HD11 ' N ' ' A' ' 51' ' ' ALA . 0.5 OUTLIER -50.75 -57.82 7.42 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 179.204 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.54 HD13 HD12 ' A' ' 80' ' ' LEU . 22.9 mm -56.04 -32.16 32.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 178.482 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -59.94 -27.83 67.12 Favored 'General case' 0 N--CA 1.442 -0.839 0 CA-C-O 121.099 0.476 . . . . 0.0 110.596 178.487 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.99 -26.87 23.57 Favored 'General case' 0 CA--C 1.521 -0.135 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.219 179.27 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.729 ' O ' HD12 ' A' ' 84' ' ' LEU . 57.0 mt -62.87 -51.03 68.57 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 108.004 -1.109 . . . . 0.0 108.004 177.6 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -61.2 -44.83 96.65 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 114.567 -1.197 . . . . 0.0 110.778 177.841 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.51 -38.78 91.26 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.005 -179.356 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.435 ' NE2' ' O ' ' A' ' 61' ' ' VAL . 42.5 mt-30 -74.23 -39.15 63.27 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.874 0.369 . . . . 0.0 110.738 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.729 HD12 ' O ' ' A' ' 80' ' ' LEU . 2.9 mt -64.96 -26.88 68.49 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.814 179.599 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 39.6 t30 -62.3 -38.15 88.28 Favored 'General case' 0 CA--C 1.523 -0.09 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.315 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 19.7 mttt -73.56 -25.33 60.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.975 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 27.5 mt -69.59 -15.58 63.24 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.271 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -76.38 -74.2 0.24 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.225 0.536 . . . . 0.0 110.927 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -83.75 161.22 21.07 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.982 179.974 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -169.76 165.21 9.95 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.93 179.864 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -128.32 -102.98 1.13 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.519 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 71.0 mt-10 -136.07 133.54 37.46 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.766 0.317 . . . . 0.0 110.939 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -113.92 109.9 19.24 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.081 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -108.39 128.52 54.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.935 179.968 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.48 89.72 3.16 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.938 179.938 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -124.28 71.8 1.15 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.116 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -106.73 120.55 42.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.167 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 82.6 p -71.47 -177.98 2.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.884 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 15.9 m -94.21 176.84 6.17 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.907 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 6.3 m -120.06 134.42 63.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.08 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 17.2 mtmt -80.46 107.76 13.53 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.044 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -155.3 174.01 15.82 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.836 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -151.18 106.3 3.32 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.132 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -149.21 33.57 0.73 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.786 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -128.89 137.79 51.64 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.887 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.453 ' O ' HG23 ' A' ' 106' ' ' VAL . 15.3 m -148.7 73.31 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.068 179.886 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 67.96 -69.25 0.15 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.061 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 61.09 90.79 0.06 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.844 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.404 HG23 ' N ' ' A' ' 110' ' ' GLU . 6.3 m -134.42 -45.89 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.212 -179.939 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 110' ' ' GLU . . . . . 0.404 ' N ' HG23 ' A' ' 109' ' ' VAL . 2.3 mt-10 62.71 31.43 16.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.939 179.985 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.01 143.38 47.57 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.837 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 18.5 pt-20 . . . . . 0 C--O 1.25 1.108 0 CA-C-O 118.248 -0.882 . . . . 0.0 111.401 -179.999 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' THR . . . . . 0.513 HG23 ' O ' ' A' ' 1' ' ' THR . 9.4 t . . . . . 0 N--CA 1.487 1.4 0 CA-C-O 120.762 0.315 . . . . 0.0 111.254 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' MET . . . . . 0.471 ' SD ' HD12 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -76.12 135.98 39.83 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.921 179.96 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 31.5 t-20 -121.89 119.06 30.49 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.42 -179.52 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 36.4 mt -118.27 123.73 72.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.476 179.363 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -134.67 160.44 38.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.97 0.414 . . . . 0.0 111.281 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 21.6 p -163.92 142.42 7.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.584 -179.67 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 10.6 mttt -100.9 28.49 5.2 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.892 -179.809 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 3.5 tp-100 -141.25 -46.08 0.38 Allowed 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.622 179.692 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 5.4 mpp? -114.0 -176.81 2.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.683 179.764 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -120.52 169.74 10.05 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.518 179.819 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.714 ' CD1' ' N ' ' A' ' 11' ' ' ILE . 0.3 OUTLIER -88.44 101.69 12.01 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.012 0 CA-C-O 121.547 0.689 . . . . 0.0 110.623 -178.474 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 17.6 p -95.55 151.1 38.32 Favored Pre-proline 0 C--N 1.322 -0.606 0 CA-C-N 114.695 -1.139 . . . . 0.0 110.877 179.735 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -54.78 -26.64 48.52 Favored 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 122.438 2.092 . . . . 0.0 111.803 179.182 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -74.48 -44.48 51.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.578 179.406 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.651 ' O ' HG23 ' A' ' 19' ' ' VAL . 21.3 mt -72.18 -27.78 27.66 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.326 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 178.987 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.5 -44.94 33.13 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.549 -0.751 . . . . 0.0 109.728 178.772 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 43.9 tt0 -67.67 -40.46 84.44 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.762 179.114 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.527 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 77.8 t60 -60.62 -58.02 10.23 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 179.167 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.651 HG23 ' O ' ' A' ' 15' ' ' ILE . 25.2 t -60.7 -47.87 91.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.693 0.282 . . . . 0.0 110.32 178.704 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.717 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -59.04 -40.6 85.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.226 -0.443 . . . . 0.0 112.039 179.662 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.527 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 0.9 OUTLIER -59.7 -35.1 73.82 Favored 'General case' 0 C--N 1.332 -0.166 0 C-N-CA 120.512 -0.475 . . . . 0.0 109.887 179.737 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.615 ' O ' HD12 ' A' ' 26' ' ' LEU . 5.6 mmm180 -76.53 -27.36 55.94 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.658 179.567 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.717 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 3.5 mt -68.54 -58.21 4.63 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.083 0.468 . . . . 0.0 110.529 179.687 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.65 -23.73 65.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.314 179.922 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 6.8 tmtt? -79.42 -29.79 42.05 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.132 0.491 . . . . 0.0 110.462 179.541 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.854 HD23 ' CD1' ' A' ' 29' ' ' TRP . 6.9 mt -79.34 58.29 2.55 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.077 -179.802 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.56 -73.49 0.08 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.216 -179.824 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.45 ' HD2' ' CE3' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -49.94 -27.78 5.8 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.216 0.531 . . . . 0.0 111.061 -179.791 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.854 ' CD1' HD23 ' A' ' 26' ' ' LEU . 34.1 m95 -87.83 45.12 1.24 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.357 179.828 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.599 ' HA ' HD11 ' A' ' 33' ' ' LEU . 27.7 mt-30 -157.43 70.51 0.6 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.112 179.749 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -77.59 -78.56 0.13 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.359 -179.086 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' HIS . . . . . 0.455 ' HB3' ' HD2' ' A' ' 56' ' ' PRO . 0.8 OUTLIER -133.24 65.11 1.6 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.565 -179.278 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.951 HD22 HG21 ' A' ' 53' ' ' ILE . 1.8 mt -89.99 146.05 24.65 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.066 179.237 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 29.3 mt -135.12 107.42 8.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 121.087 0.47 . . . . 0.0 112.036 -179.524 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 1.9 m120 51.67 74.36 0.81 Allowed Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 115.583 -0.735 . . . . 0.0 112.165 179.077 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.513 ' HB3' HG23 ' A' ' 53' ' ' ILE . 95.3 Cg_endo -78.55 131.09 10.22 Favored 'Trans proline' 0 N--CA 1.463 -0.319 0 C-N-CA 122.557 2.172 . . . . 0.0 111.524 179.162 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' HIS . . . . . 0.504 ' C ' HD12 ' A' ' 38' ' ' ILE . 1.7 t-160 -107.43 129.79 54.89 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.07 0.462 . . . . 0.0 111.778 -179.261 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.642 HD12 ' N ' ' A' ' 38' ' ' ILE . 3.4 mp -121.09 133.17 68.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.526 179.45 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 5.2 mt -118.89 149.2 21.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.228 -179.78 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 8.9 mt -124.93 126.86 46.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.89 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 34.6 m -123.49 -173.83 2.82 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.507 179.739 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.432 ' HG3' ' CD2' ' A' ' 47' ' ' PHE . 3.4 ttpt -160.48 139.05 10.22 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.306 0.574 . . . . 0.0 111.333 -179.644 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -130.76 156.56 79.71 Favored Pre-proline 0 C--N 1.323 -0.583 0 CA-C-N 115.129 -0.941 . . . . 0.0 109.281 179.146 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_exo -51.34 -24.55 16.11 Favored 'Trans proline' 0 C--O 1.232 0.187 0 C-N-CA 121.974 1.783 . . . . 0.0 112.481 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -89.07 -6.2 57.29 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.456 -0.793 . . . . 0.0 112.662 -179.242 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 149.16 -161.55 28.76 Favored Glycine 0 C--O 1.224 -0.48 0 C-N-CA 120.245 -0.979 . . . . 0.0 112.129 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.432 ' CD2' ' HG3' ' A' ' 42' ' ' LYS . 16.9 m-85 -110.36 154.59 23.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.523 0.678 . . . . 0.0 111.98 179.923 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.528 HG22 ' HG2' ' A' ' 65' ' ' LYS . 68.8 t -128.08 139.34 52.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 114.867 -1.06 . . . . 0.0 110.94 -179.266 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.437 ' O ' ' HA ' ' A' ' 63' ' ' SER . . . -131.27 124.51 30.65 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.761 179.715 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -118.96 147.98 43.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.743 0.306 . . . . 0.0 110.999 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.499 ' N ' HD11 ' A' ' 76' ' ' LEU . . . -144.29 141.42 29.79 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.558 179.886 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.1 m -135.79 130.3 33.83 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.014 179.4 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.951 HG21 HD22 ' A' ' 33' ' ' LEU . 11.7 mt -130.54 134.19 62.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 120.825 0.345 . . . . 0.0 110.904 -179.54 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -104.24 133.49 49.07 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.68 179.623 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.42 HG22 ' HA ' ' A' ' 33' ' ' LEU . 6.3 p -134.29 135.25 23.7 Favored Pre-proline 0 C--N 1.326 -0.421 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.347 179.476 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.455 ' HD2' ' HB3' ' A' ' 32' ' ' HIS . 80.8 Cg_exo -45.87 -20.81 0.81 Allowed 'Trans proline' 0 CA--C 1.53 0.29 0 C-N-CA 122.381 2.054 . . . . 0.0 112.921 179.853 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -111.48 20.69 16.97 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 112.095 0.406 . . . . 0.0 112.095 -179.571 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 142.44 -174.71 23.25 Favored Glycine 0 C--N 1.332 0.342 0 C-N-CA 120.286 -0.959 . . . . 0.0 113.319 179.52 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.638 HG13 ' O ' ' A' ' 53' ' ' ILE . 21.2 t -143.85 139.62 25.35 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-O 120.789 0.328 . . . . 0.0 111.005 -179.936 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.5 mp -117.85 153.76 32.97 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.009 0.433 . . . . 0.0 111.612 -179.418 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 16.7 t -140.49 145.64 25.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.714 179.742 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -153.15 152.57 31.42 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.189 0.519 . . . . 0.0 111.841 -179.579 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' SER . . . . . 0.483 ' HA ' HD12 ' A' ' 76' ' ' LEU . 0.1 OUTLIER -144.89 158.08 43.93 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.666 -179.437 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.615 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -151.55 105.28 0.28 Allowed Glycine 0 C--N 1.331 0.298 0 N-CA-C 111.497 -0.641 . . . . 0.0 111.497 179.341 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.528 ' HG2' HG22 ' A' ' 48' ' ' VAL . 0.3 OUTLIER -106.71 44.83 1.02 Allowed 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.281 0.474 . . . . 0.0 112.281 -178.834 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 16.5 t-80 -75.4 156.36 35.45 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.635 -0.257 . . . . 0.0 110.317 178.601 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -59.61 -28.62 67.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.489 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 9.0 t0 -97.98 119.6 36.9 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.972 0.415 . . . . 0.0 111.566 -179.292 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.422 ' O ' HD12 ' A' ' 73' ' ' ILE . 3.7 ttt -47.86 -47.01 31.84 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.516 179.846 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 35.5 m-85 -66.45 -42.28 87.82 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.151 -179.521 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 56.7 m -65.33 -37.4 86.98 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.669 179.881 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.615 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -62.4 -50.6 70.88 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.747 179.588 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.483 HG21 HG22 ' A' ' 19' ' ' VAL . 6.7 mt -61.97 -41.3 90.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 179.412 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -64.44 -41.45 96.56 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.062 179.091 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -66.31 -39.43 89.31 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.496 179.367 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.733 HD23 HG13 ' A' ' 77' ' ' ILE . 0.4 OUTLIER -54.97 -63.73 1.06 Allowed 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 179.079 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.733 HG13 HD23 ' A' ' 76' ' ' LEU . 4.8 mt -54.64 -26.89 17.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 110.274 -0.269 . . . . 0.0 110.274 178.871 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.23 -40.22 85.21 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-O 121.48 0.657 . . . . 0.0 109.282 178.087 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 7.3 mmtm -73.94 -31.38 63.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 114.916 -1.038 . . . . 0.0 110.205 178.817 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.79 ' O ' HD12 ' A' ' 84' ' ' LEU . 84.7 mt -62.88 -47.38 83.57 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 107.817 -1.179 . . . . 0.0 107.817 177.593 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.443 ' HG2' ' CE2' ' A' ' 29' ' ' TRP . 6.3 tt0 -60.73 -46.25 91.14 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 114.821 -1.082 . . . . 0.0 110.32 177.65 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.42 -31.24 72.34 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.741 -179.858 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 -74.81 -45.32 44.29 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.942 0.401 . . . . 0.0 110.436 179.684 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.79 HD12 ' O ' ' A' ' 80' ' ' LEU . 1.4 mt -65.28 -26.17 67.96 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.865 179.681 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -62.71 -31.94 72.95 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.055 0.455 . . . . 0.0 110.357 179.647 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.32 -19.97 60.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.246 179.888 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 90.2 mt -69.26 -17.18 63.73 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.359 -179.808 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -76.27 -5.45 47.04 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.426 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.48 ' N ' ' CD2' ' A' ' 89' ' ' HIS . 1.3 p80 -154.84 137.8 15.47 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.926 0.393 . . . . 0.0 110.961 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 23.8 tptt -170.37 -68.49 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.966 179.605 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 107.35 28.01 5.06 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.484 -179.918 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -84.5 -177.81 6.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.807 0.337 . . . . 0.0 110.93 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -143.94 129.04 18.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.043 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 6.2 ttp180 -93.38 -33.85 13.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.911 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.25 115.38 18.24 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.929 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . 61.95 90.63 0.07 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.12 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -72.86 -24.13 60.83 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.202 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 2.6 m 70.66 -64.35 0.38 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.945 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -54.88 160.13 2.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.949 -179.972 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 28.3 m -126.44 155.19 36.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.245 -179.909 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 41.3 mttt -111.55 -33.37 6.39 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.905 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 61.87 77.38 0.33 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.865 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -175.51 -77.56 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.097 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 59.14 -172.45 0.11 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.871 179.869 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -151.63 169.45 22.1 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.838 -179.949 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.526 HG13 ' O ' ' A' ' 106' ' ' VAL . 10.8 p -87.06 59.09 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.984 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -101.69 124.36 47.2 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.866 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -140.57 95.79 2.92 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.819 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.453 HG23 ' N ' ' A' ' 110' ' ' GLU . 12.1 m -141.8 -47.18 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.138 179.88 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 110' ' ' GLU . . . . . 0.453 ' N ' HG23 ' A' ' 109' ' ' VAL . 4.1 mt-10 -124.88 145.19 49.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.902 179.974 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -176.16 78.07 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.922 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.199 -0.905 . . . . 0.0 110.899 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.487 1.401 0 CA-C-O 120.921 0.391 . . . . 0.0 111.209 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' MET . . . . . 0.405 ' HB3' ' CD1' ' A' ' 23' ' ' LEU . 0.1 OUTLIER -62.35 132.93 54.24 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.694 179.942 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -124.45 130.52 52.62 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.297 -179.666 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 39.6 mt -136.2 124.82 37.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.667 179.621 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -134.45 160.74 37.04 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.941 0.401 . . . . 0.0 111.255 -179.962 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.415 ' HB3' ' HB2' ' A' ' 40' ' ' LEU . 21.9 p -162.67 145.75 11.09 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.39 -179.474 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.47 30.05 4.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.404 -179.47 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -142.39 -53.87 0.42 Allowed 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.806 179.579 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 2.1 mpp? -109.23 -176.68 3.09 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.803 179.8 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -115.72 168.74 9.76 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.666 179.754 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.465 HG22 ' HG3' ' A' ' 16' ' ' ARG . 5.1 mm -90.5 114.01 27.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 121.043 0.449 . . . . 0.0 111.143 -179.385 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 13.6 p -99.8 157.72 33.4 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.911 179.632 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -61.7 -15.76 44.21 Favored 'Trans proline' 0 C--N 1.343 0.265 0 C-N-CA 122.482 2.121 . . . . 0.0 111.88 179.056 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -83.15 -41.06 18.94 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-O 121.019 0.438 . . . . 0.0 110.263 179.181 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.45 ' O ' HG23 ' A' ' 19' ' ' VAL . 42.2 mt -72.79 -29.09 28.73 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.285 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 178.801 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.465 ' HG3' HG22 ' A' ' 11' ' ' ILE . 75.9 mtt180 -73.45 -47.33 42.35 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.521 178.667 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -67.15 -38.46 85.54 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.89 179.149 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.491 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 75.5 t60 -59.53 -62.7 1.68 Allowed 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.872 -0.418 . . . . 0.0 109.872 179.17 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.715 HG13 HD11 ' A' ' 77' ' ' ILE . 22.6 t -60.82 -47.57 92.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.735 178.95 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.669 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -56.68 -44.84 81.85 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 111.855 0.317 . . . . 0.0 111.855 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.491 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 1.1 p30 -59.34 -32.97 70.58 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.044 0.449 . . . . 0.0 110.408 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 31.3 mmt180 -75.13 -28.85 60.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.859 179.793 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.681 HD21 HG12 ' A' ' 19' ' ' VAL . 3.5 mt -69.17 -54.43 14.91 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.96 0.41 . . . . 0.0 110.659 179.653 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.51 -25.93 62.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.103 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.3 -32.3 43.48 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.268 0.556 . . . . 0.0 109.875 178.965 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.615 ' HB3' ' HB2' ' A' ' 29' ' ' TRP . 31.6 mt -81.07 60.31 4.19 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.673 179.757 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -59.61 -76.3 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.536 -179.412 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.437 ' HG2' ' CD1' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -52.59 -21.84 4.33 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.084 0.468 . . . . 0.0 112.027 -179.6 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.615 ' HB2' ' HB3' ' A' ' 26' ' ' LEU . 50.2 m95 -85.5 -57.03 3.23 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.27 -178.623 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.419 ' CG ' HD12 ' A' ' 33' ' ' LEU . 0.0 OUTLIER -91.97 33.42 1.06 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.767 0.317 . . . . 0.0 111.04 -179.905 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.404 ' CG2' ' N ' ' A' ' 32' ' ' HIS . 0.6 OUTLIER -81.93 -46.68 13.71 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.263 -179.646 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 32' ' ' HIS . . . . . 0.404 ' N ' ' CG2' ' A' ' 31' ' ' THR . 35.8 m170 -84.47 -26.9 27.86 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.545 -179.394 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.697 HD23 HG22 ' A' ' 55' ' ' THR . 58.7 mt -50.27 146.65 4.93 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.029 -179.845 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.434 HD11 ' HG3' ' A' ' 56' ' ' PRO . 18.3 mt -133.13 105.43 8.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-O 120.759 0.314 . . . . 0.0 111.693 -179.67 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 51.7 78.78 0.38 Allowed Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.589 179.289 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.484 ' HB3' HG23 ' A' ' 53' ' ' ILE . 95.2 Cg_endo -81.88 161.38 18.59 Favored 'Trans proline' 0 N--CA 1.462 -0.35 0 C-N-CA 122.779 2.319 . . . . 0.0 112.241 179.61 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 1.7 t-160 -136.68 128.77 29.59 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.918 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.59 HD12 ' N ' ' A' ' 38' ' ' ILE . 3.7 mp -120.61 137.52 54.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.2 179.949 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 4.3 mp -114.7 148.28 17.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.877 179.927 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.415 ' HB2' ' HB3' ' A' ' 6' ' ' SER . 10.0 mt -123.34 127.5 48.59 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.939 0.4 . . . . 0.0 111.018 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -125.06 -170.97 2.26 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.645 179.918 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.471 ' HA ' ' HA ' ' A' ' 47' ' ' PHE . 2.7 ttmm -171.35 145.12 2.09 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.202 0.525 . . . . 0.0 111.039 -179.855 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.46 ' N ' ' HG2' ' A' ' 42' ' ' LYS . 2.2 mm-40 -130.1 166.28 27.64 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.015 178.816 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' PRO . . . . . 0.429 ' HD2' ' HB3' ' A' ' 43' ' ' GLU . 80.1 Cg_exo -48.72 -19.84 2.38 Favored 'Trans proline' 0 N--CA 1.463 -0.28 0 C-N-CA 121.837 1.691 . . . . 0.0 112.622 -178.946 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -85.38 -77.21 0.3 Allowed 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.004 179.078 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.463 ' HA3' ' HA ' ' A' ' 67' ' ' GLU . . . -142.37 -153.69 5.97 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.629 -179.409 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.471 ' HA ' ' HA ' ' A' ' 42' ' ' LYS . 21.6 m-85 -109.29 150.5 27.88 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-O 121.709 0.766 . . . . 0.0 112.583 -179.354 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.612 HG22 ' CG ' ' A' ' 65' ' ' LYS . 59.8 t -124.37 140.39 47.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 114.397 -1.274 . . . . 0.0 110.254 179.955 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -131.62 124.98 31.07 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.66 0.267 . . . . 0.0 110.812 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -119.13 148.26 43.26 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.443 179.679 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.564 ' N ' HD11 ' A' ' 76' ' ' LEU . . . -147.11 144.38 28.99 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.981 0.42 . . . . 0.0 112.063 179.84 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.0 m -136.75 129.29 30.26 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.704 179.163 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.669 ' O ' HG13 ' A' ' 59' ' ' VAL . 9.0 mt -131.13 140.93 47.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-O 121.053 0.454 . . . . 0.0 111.716 -179.23 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -100.6 140.86 34.27 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.891 179.321 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.697 HG22 HD23 ' A' ' 33' ' ' LEU . 5.9 p -133.8 156.41 79.42 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.002 179.448 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.434 ' HG3' HD11 ' A' ' 34' ' ' ILE . 19.6 Cg_exo -65.24 -11.04 28.21 Favored 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 122.244 1.962 . . . . 0.0 112.659 -179.572 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 53.3 m-80 -125.92 21.4 7.55 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 111.75 0.278 . . . . 0.0 111.75 -179.605 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 143.95 -166.73 26.97 Favored Glycine 0 C--N 1.331 0.297 0 C-N-CA 120.258 -0.972 . . . . 0.0 113.181 179.627 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.669 HG13 ' O ' ' A' ' 53' ' ' ILE . 16.6 t -140.13 143.63 29.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 120.68 0.276 . . . . 0.0 110.986 -179.921 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.525 HD23 ' HB2' ' A' ' 83' ' ' GLN . 6.5 mp -118.01 152.16 36.05 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.919 0.39 . . . . 0.0 111.447 -179.676 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 19.6 t -140.8 147.31 22.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.881 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.413 ' HB1' ' HB2' ' A' ' 79' ' ' LYS . . . -153.91 156.73 38.06 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.235 0.54 . . . . 0.0 111.637 -179.724 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' SER . . . . . 0.408 ' HA ' HD12 ' A' ' 76' ' ' LEU . 26.5 p -144.4 158.22 43.86 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.738 -179.341 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.75 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -152.91 105.28 0.27 Allowed Glycine 0 C--N 1.334 0.418 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.731 179.638 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.612 ' CG ' HG22 ' A' ' 48' ' ' VAL . 3.0 mptt -107.1 44.93 1.02 Allowed 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -178.905 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.651 ' ND1' HG21 ' A' ' 71' ' ' THR . 12.6 t-80 -76.21 156.46 33.58 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.802 0.335 . . . . 0.0 110.233 178.596 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.463 ' HA ' ' HA3' ' A' ' 46' ' ' GLY . 5.0 mt-10 -61.38 -26.45 67.84 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.781 0.324 . . . . 0.0 111.132 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -98.32 122.13 41.12 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.034 0.445 . . . . 0.0 111.372 -179.48 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.681 ' HE3' HD11 ' A' ' 73' ' ' ILE . 0.8 OUTLIER -47.93 -49.64 29.5 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.817 179.901 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 18.4 m-85 -65.96 -37.02 84.92 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.587 -179.158 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.651 HG21 ' ND1' ' A' ' 66' ' ' HIS . 97.9 m -64.59 -41.52 96.19 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.695 0.283 . . . . 0.0 110.559 -179.901 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.75 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -61.55 -47.66 84.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.522 179.514 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.681 HD11 ' HE3' ' A' ' 69' ' ' MET . 14.1 mt -60.93 -46.34 96.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.584 179.553 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -64.44 -40.73 96.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.55 179.624 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -65.73 -44.53 85.72 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.604 179.795 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.564 HD11 ' N ' ' A' ' 51' ' ' ALA . 0.3 OUTLIER -53.23 -59.39 4.62 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.368 179.402 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.715 HD11 HG13 ' A' ' 19' ' ' VAL . 44.3 mt -56.12 -29.88 28.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 N-CA-C 110.183 -0.303 . . . . 0.0 110.183 179.023 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.405 ' ND2' ' C ' ' A' ' 78' ' ' ASN . 0.0 OUTLIER -58.72 -38.2 77.83 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.446 0.641 . . . . 0.0 109.668 178.45 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.413 ' HB2' ' HB1' ' A' ' 62' ' ' ALA . 0.0 OUTLIER -73.77 -29.17 62.05 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.01 178.937 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.474 HD12 ' HA ' ' A' ' 77' ' ' ILE . 94.8 mt -62.06 -48.81 78.57 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 107.759 -1.2 . . . . 0.0 107.759 177.379 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.455 ' O ' ' CZ3' ' A' ' 29' ' ' TRP . 11.9 tt0 -62.68 -44.34 96.51 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 114.514 -1.221 . . . . 0.0 110.481 177.76 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.68 -32.13 73.15 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.028 -179.367 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.525 ' HB2' HD23 ' A' ' 60' ' ' LEU . 25.0 mt-30 -74.91 -41.75 59.11 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.123 0.487 . . . . 0.0 110.38 179.788 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.496 ' HA ' HD12 ' A' ' 87' ' ' LEU . 0.4 OUTLIER -65.11 -32.15 73.71 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.772 179.682 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ASN . . . . . 0.465 ' O ' ' HG3' ' A' ' 88' ' ' GLN . 11.6 t-20 -61.37 -33.6 73.91 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.549 -178.969 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.495 ' HA ' ' CE1' ' A' ' 89' ' ' HIS . 21.6 mttm -77.11 -27.45 54.05 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.335 -179.753 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.496 HD12 ' HA ' ' A' ' 84' ' ' LEU . 47.8 mt -72.29 -23.13 61.14 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 -178.752 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.465 ' HG3' ' O ' ' A' ' 85' ' ' ASN . 1.8 pt20 -78.24 -102.8 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 111.719 0.266 . . . . 0.0 111.719 -178.933 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.495 ' CE1' ' HA ' ' A' ' 86' ' ' LYS . 10.6 m-70 62.54 -72.69 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.007 0.432 . . . . 0.0 111.119 -179.226 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.46 ' N ' ' O ' ' A' ' 88' ' ' GLN . 40.4 mttm -69.91 -68.34 0.42 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.075 -179.266 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 143.76 -162.99 27.71 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.425 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -163.74 118.3 1.56 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.813 0.339 . . . . 0.0 110.9 179.942 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -98.29 38.09 1.37 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.156 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -92.77 109.36 20.79 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.929 -179.983 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.14 169.33 8.94 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.883 179.971 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -99.02 34.67 2.06 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.062 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -83.69 97.21 8.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.098 -179.944 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -148.37 160.83 42.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.949 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -139.43 100.74 4.06 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.873 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.489 HG22 ' N ' ' A' ' 101' ' ' LYS . 10.0 p -160.19 158.63 2.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.132 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.489 ' N ' HG22 ' A' ' 100' ' ' VAL . 0.0 OUTLIER -173.77 -36.41 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.179 179.975 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 102' ' ' ASP . . . . . 0.415 ' N ' ' HG2' ' A' ' 101' ' ' LYS . 0.7 OUTLIER 61.35 77.2 0.34 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.877 0.37 . . . . 0.0 110.971 -179.978 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -120.63 82.18 1.87 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.084 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -111.45 44.99 1.25 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.93 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.682 ' O ' HG12 ' A' ' 106' ' ' VAL . 52.2 t80 63.42 139.93 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.903 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.682 HG12 ' O ' ' A' ' 105' ' ' PHE . 9.5 p 51.51 163.69 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.92 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 107' ' ' GLU . . . . . 0.483 ' N ' HG22 ' A' ' 106' ' ' VAL . 5.3 tt0 67.77 129.55 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.038 -179.793 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -160.13 -64.3 0.07 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.85 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 5.7 m -142.35 149.14 19.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.095 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 60.83 -172.22 0.14 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.889 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -130.43 -65.38 0.81 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.903 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.212 -0.899 . . . . 0.0 110.842 -179.955 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 6.2 t . . . . . 0 N--CA 1.487 1.417 0 CA-C-O 120.872 0.367 . . . . 0.0 111.209 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' MET . . . . . 0.654 ' HG3' HD11 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -145.12 169.38 18.27 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.858 -179.944 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -122.11 120.67 34.94 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.879 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.469 HG23 ' O ' ' A' ' 4' ' ' ILE . 12.5 tt -125.58 124.42 66.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.731 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 3.0 p -134.51 163.73 29.05 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.832 0.348 . . . . 0.0 111.247 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 42.3 p -163.3 131.43 3.72 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.348 -179.5 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 11.7 mttt -100.7 42.39 1.12 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.914 -179.718 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -140.06 -46.14 0.43 Allowed 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.505 179.572 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 10.0 mtm -134.67 -178.87 5.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.468 179.664 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -89.93 164.35 14.6 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.673 179.863 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.0 mm -90.79 116.95 33.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.936 0.398 . . . . 0.0 110.859 -179.669 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 16.0 p -100.6 146.6 32.33 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.091 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_exo -55.33 -21.22 28.36 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.36 2.04 . . . . 0.0 111.652 179.12 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -74.72 -42.33 58.53 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 121.197 0.522 . . . . 0.0 110.287 179.331 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 38.8 mt -72.31 -30.42 35.21 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.305 178.888 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.438 ' O ' ' CB ' ' A' ' 20' ' ' ALA . 7.9 mtt180 -73.2 -46.41 50.6 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.602 178.666 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 47.5 tt0 -66.79 -37.0 83.7 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.641 179.106 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.479 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 50.2 t60 -59.88 -65.28 0.7 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.854 0.359 . . . . 0.0 110.067 179.014 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.646 HG12 HD21 ' A' ' 23' ' ' LEU . 21.6 t -60.18 -46.5 94.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.97 179.168 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.645 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -57.26 -45.34 84.09 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 179.95 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.479 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 1.5 p30 -59.46 -31.56 69.43 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 120.809 -0.356 . . . . 0.0 110.64 -179.857 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 16.6 mmt180 -74.75 -28.6 60.83 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.81 179.726 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.654 HD11 ' HG3' ' A' ' 2' ' ' MET . 1.6 mt -68.32 -51.61 42.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.935 0.398 . . . . 0.0 110.362 179.326 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.29 -24.13 63.02 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.823 179.592 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 7.0 tptp -77.43 -34.05 54.73 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.29 179.339 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.726 HD23 ' HE1' ' A' ' 29' ' ' TRP . 0.5 OUTLIER -81.33 55.31 2.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.715 179.37 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -116.01 -1.43 12.51 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.59 -179.714 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -70.92 -10.55 59.87 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.8 0.333 . . . . 0.0 111.359 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.898 ' CD2' HD21 ' A' ' 84' ' ' LEU . 62.1 m95 -84.67 -179.88 7.22 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.134 -179.908 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -114.58 -14.99 12.05 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.565 -179.82 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.527 HG23 ' O ' ' A' ' 31' ' ' THR . 15.1 t -76.57 111.43 12.04 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.151 0.501 . . . . 0.0 110.556 179.694 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 43.8 m80 -60.28 169.23 1.7 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.32 -179.565 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 1.069 HD23 HG21 ' A' ' 53' ' ' ILE . 2.2 mp -143.22 130.15 20.55 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.174 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.8 mp -121.89 103.15 13.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 121.439 0.638 . . . . 0.0 112.135 -179.167 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 8.2 m120 50.43 78.62 0.39 Allowed Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 114.887 -1.052 . . . . 0.0 112.48 178.773 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.513 ' HB3' HG23 ' A' ' 53' ' ' ILE . 94.8 Cg_endo -83.38 133.31 6.25 Favored 'Trans proline' 0 N--CA 1.459 -0.532 0 C-N-CA 122.665 2.244 . . . . 0.0 111.132 178.673 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' HIS . . . . . 0.453 ' C ' HD12 ' A' ' 38' ' ' ILE . 0.7 OUTLIER -105.07 127.36 52.85 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.065 0.46 . . . . 0.0 111.959 -179.01 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.635 HD12 ' N ' ' A' ' 38' ' ' ILE . 3.3 mp -120.16 134.09 64.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.062 179.168 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 39.1 mt -116.27 148.42 19.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.42 -179.635 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.2 mt -123.79 127.53 48.22 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.713 179.72 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -125.54 -170.52 2.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.712 -179.916 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.486 ' HA ' ' HA ' ' A' ' 47' ' ' PHE . 0.0 OUTLIER -171.56 145.43 2.04 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.243 0.544 . . . . 0.0 110.943 -179.833 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.449 ' HB3' ' HD2' ' A' ' 44' ' ' PRO . 2.8 mm-40 -130.38 164.9 38.01 Favored Pre-proline 0 C--N 1.323 -0.581 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.197 179.099 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' PRO . . . . . 0.449 ' HD2' ' HB3' ' A' ' 43' ' ' GLU . 3.2 Cg_endo -46.79 -21.82 1.64 Allowed 'Trans proline' 0 N--CA 1.462 -0.355 0 C-N-CA 122.239 1.959 . . . . 0.0 112.363 -179.282 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 45.5 tp60 -84.27 -78.6 0.23 Allowed 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.769 179.105 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.439 ' HA3' ' HA ' ' A' ' 67' ' ' GLU . . . -141.07 -152.72 5.8 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.671 -179.288 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.486 ' HA ' ' HA ' ' A' ' 42' ' ' LYS . 19.6 m-85 -110.37 151.06 27.91 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.731 0.777 . . . . 0.0 112.819 -179.249 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.556 HG22 ' HG2' ' A' ' 65' ' ' LYS . 67.0 t -123.89 140.54 47.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 114.393 -1.276 . . . . 0.0 110.251 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.423 ' O ' ' HA ' ' A' ' 63' ' ' SER . . . -132.18 124.83 29.8 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.642 0.258 . . . . 0.0 111.003 -179.853 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -117.19 147.96 42.03 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.287 179.629 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.661 ' N ' HD11 ' A' ' 76' ' ' LEU . . . -144.97 142.74 30.08 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.998 0.428 . . . . 0.0 111.852 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.0 m -135.02 130.18 35.27 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.848 179.324 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 1.069 HG21 HD23 ' A' ' 33' ' ' LEU . 16.1 mt -130.52 137.22 56.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.06 0.457 . . . . 0.0 111.464 -179.352 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -101.94 137.19 40.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.749 179.549 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 6.3 p -132.5 161.2 64.68 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.302 179.576 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_exo -68.12 -9.31 25.37 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.43 2.087 . . . . 0.0 112.582 -179.559 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -117.23 -3.71 11.46 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 111.744 0.275 . . . . 0.0 111.744 -179.773 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 158.33 -166.29 34.15 Favored Glycine 0 C--N 1.331 0.304 0 C-N-CA 120.366 -0.921 . . . . 0.0 112.754 179.959 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.668 HG13 ' O ' ' A' ' 53' ' ' ILE . 21.2 t -134.02 140.87 45.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 120.845 0.355 . . . . 0.0 111.161 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.565 HD21 HD21 ' A' ' 87' ' ' LEU . 11.0 mt -115.54 156.91 24.88 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.027 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.412 ' O ' ' NE2' ' A' ' 83' ' ' GLN . 21.1 t -140.31 149.69 21.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.008 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.418 ' O ' HD12 ' A' ' 76' ' ' LEU . . . -154.5 155.56 35.09 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.19 0.519 . . . . 0.0 111.544 -179.799 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' SER . . . . . 0.423 ' HA ' ' O ' ' A' ' 49' ' ' ALA . 0.5 OUTLIER -145.45 158.08 43.9 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.759 -179.277 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.43 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -151.88 109.19 0.41 Allowed Glycine 0 C--N 1.331 0.257 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.628 179.505 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.556 ' HG2' HG22 ' A' ' 48' ' ' VAL . 1.0 OUTLIER -109.24 45.02 1.09 Allowed 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -178.861 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 13.0 t-80 -76.22 156.01 33.95 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.784 0.325 . . . . 0.0 110.367 178.651 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.439 ' HA ' ' HA3' ' A' ' 46' ' ' GLY . 0.3 OUTLIER -61.53 -27.52 68.67 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.723 0.297 . . . . 0.0 111.36 -179.84 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -98.2 121.47 40.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.012 0.434 . . . . 0.0 111.508 -179.39 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -47.95 -50.42 27.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.813 179.865 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 43.0 m-85 -66.85 -44.14 81.79 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.775 -179.016 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 16.8 m -63.96 -42.03 97.39 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.801 0.334 . . . . 0.0 110.883 -179.701 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.43 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -61.5 -47.99 83.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.715 179.611 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.621 HG21 HG22 ' A' ' 19' ' ' VAL . 16.4 mt -58.67 -44.28 89.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.96 0.41 . . . . 0.0 110.44 179.636 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -63.41 -36.11 82.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.362 179.373 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -64.85 -41.67 95.51 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.156 -0.475 . . . . 0.0 109.856 179.182 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.661 HD11 ' N ' ' A' ' 51' ' ' ALA . 0.2 OUTLIER -54.87 -59.9 4.1 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 178.878 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.65 HG13 HD23 ' A' ' 76' ' ' LEU . 6.9 mt -56.25 -30.48 30.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 110.013 -0.365 . . . . 0.0 110.013 178.727 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -59.85 -31.74 70.04 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-O 121.304 0.573 . . . . 0.0 110.157 178.196 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 7.2 mmtt -82.85 -24.87 33.06 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.485 179.162 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.574 HD13 HD11 ' A' ' 53' ' ' ILE . 93.4 mt -64.3 -47.63 78.71 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 107.574 -1.269 . . . . 0.0 107.574 177.111 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.575 ' O ' HD12 ' A' ' 84' ' ' LEU . 3.4 tt0 -59.31 -44.69 92.52 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 114.619 -1.173 . . . . 0.0 110.815 177.972 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -69.25 -37.08 77.76 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.706 -179.591 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.412 ' NE2' ' O ' ' A' ' 61' ' ' VAL . 36.6 mt-30 -78.19 -48.55 15.61 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 -178.665 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.967 HD13 ' N ' ' A' ' 85' ' ' ASN . 0.0 OUTLIER -63.7 -14.8 55.54 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 120.672 -0.411 . . . . 0.0 111.082 -179.402 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ASN . . . . . 0.967 ' N ' HD13 ' A' ' 84' ' ' LEU . 0.2 OUTLIER -67.73 -28.23 67.47 Favored 'General case' 0 N--CA 1.457 -0.099 0 CA-C-O 121.152 0.501 . . . . 0.0 110.1 178.762 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 4.0 mmtm -71.04 -9.54 58.2 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.323 -179.757 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.565 HD21 HD21 ' A' ' 60' ' ' LEU . 14.7 mt -69.58 -26.45 64.48 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.861 0.362 . . . . 0.0 110.94 179.744 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -75.92 -10.09 59.14 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.329 -179.854 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -85.89 -60.76 1.92 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.983 0.421 . . . . 0.0 110.734 179.728 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 42.92 -166.8 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.613 -179.878 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -117.27 -17.46 5.73 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.806 -179.741 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 61.47 103.37 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.904 0.383 . . . . 0.0 110.944 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -161.12 120.62 2.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.081 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 2.8 ptt180 -146.75 83.66 1.59 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.97 -179.947 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -173.85 -171.98 0.7 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.874 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -86.6 -48.62 8.17 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.057 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -136.17 178.31 7.16 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.1 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' THR . . . . . 0.418 HG23 ' H ' ' A' ' 99' ' ' SER . 1.4 t -129.55 -52.95 1.17 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.956 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 99' ' ' SER . . . . . 0.418 ' H ' HG23 ' A' ' 98' ' ' THR . 0.1 OUTLIER -165.91 -60.74 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.863 179.982 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 21.5 t -139.31 116.94 11.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.171 -179.893 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -161.99 179.33 8.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.928 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -171.63 142.2 1.56 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.876 179.935 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -102.63 132.56 48.65 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.167 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 28.9 m-20 -96.44 92.4 6.28 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.92 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 38.2 t80 -69.65 -48.11 61.01 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.916 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 21.5 t 63.82 139.19 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.111 179.97 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -100.59 -179.82 4.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.867 -179.949 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 66.39 -71.82 0.09 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.126 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 21.4 t 64.26 135.52 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.16 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -98.17 -176.67 3.49 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.823 179.973 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -117.14 -40.99 3.04 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.894 179.987 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.314 -0.85 . . . . 0.0 110.924 179.855 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' THR . . . . . 0.425 HG23 ' O ' ' A' ' 1' ' ' THR . 2.9 t . . . . . 0 N--CA 1.486 1.342 0 CA-C-O 120.857 0.361 . . . . 0.0 111.225 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' MET . . . . . 0.588 ' CE ' ' HB2' ' A' ' 20' ' ' ALA . 1.2 ptt? -59.3 149.04 29.95 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.867 179.967 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -121.95 128.55 51.63 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.107 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 36.9 mt -129.13 124.31 60.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.718 179.663 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -135.63 161.01 36.73 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.042 0.449 . . . . 0.0 111.397 -179.909 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 21.6 p -163.67 141.02 7.25 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.325 -179.682 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -100.36 27.74 5.5 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.183 -179.396 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -142.38 -45.34 0.33 Allowed 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.791 179.625 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 5.0 mpp? -113.23 -176.23 2.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.66 179.764 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -118.85 165.63 13.8 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.503 179.705 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 5.7 mm -89.73 109.3 20.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 121.149 0.499 . . . . 0.0 111.101 -179.413 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 16.1 p -98.19 159.09 31.54 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 115.428 -0.806 . . . . 0.0 110.986 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.431 ' HA ' ' HG2' ' A' ' 16' ' ' ARG . 23.6 Cg_exo -62.54 -13.5 33.84 Favored 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 122.579 2.186 . . . . 0.0 111.919 179.006 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -86.59 -41.93 13.89 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.959 0.409 . . . . 0.0 110.597 179.483 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 25.5 mt -71.93 -31.52 40.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.844 -0.616 . . . . 0.0 109.587 179.44 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.449 ' O ' ' HE1' ' A' ' 2' ' ' MET . 26.6 ptt180 -72.93 -44.24 61.43 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.485 178.796 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.401 ' N ' ' CG ' ' A' ' 16' ' ' ARG . 1.9 tm0? -65.62 -38.7 90.19 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.635 179.078 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.581 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 78.2 t60 -60.36 -50.05 75.16 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.48 -0.488 . . . . 0.0 109.685 178.787 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.704 ' O ' ' HG3' ' A' ' 22' ' ' ARG . 79.7 t -63.64 -44.01 98.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 177.982 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.684 ' HA ' ' HB2' ' A' ' 23' ' ' LEU . . . -63.24 -37.06 85.76 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.907 -0.317 . . . . 0.0 111.783 179.915 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.581 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 0.8 OUTLIER -60.3 -44.03 95.79 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 -179.611 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.784 ' HD3' HG21 ' A' ' 77' ' ' ILE . 1.6 ppt_? -74.75 -16.63 60.72 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.728 0.775 . . . . 0.0 109.01 178.372 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.684 ' HB2' ' HA ' ' A' ' 20' ' ' ALA . 0.2 OUTLIER -70.2 -63.78 1.02 Allowed 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 114.387 -1.279 . . . . 0.0 109.918 178.858 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.01 -21.14 65.94 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.185 179.338 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.12 -29.81 38.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.993 0.425 . . . . 0.0 110.935 179.789 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.84 HD23 ' CD1' ' A' ' 29' ' ' TRP . 9.1 mt -79.19 60.52 3.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.028 -179.582 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.434 ' HA ' ' HG2' ' A' ' 30' ' ' GLN . 0.1 OUTLIER -65.93 -69.52 0.29 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.601 -179.721 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.402 ' HG3' ' CD1' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -51.08 -23.79 3.4 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.281 0.562 . . . . 0.0 111.736 -179.683 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.84 ' CD1' HD23 ' A' ' 26' ' ' LEU . 73.1 m95 -85.14 -42.03 15.13 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.311 -0.859 . . . . 0.0 112.591 -178.754 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.434 ' HG2' ' HA ' ' A' ' 27' ' ' GLU . 0.5 OUTLIER -68.35 69.62 0.15 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.964 0.411 . . . . 0.0 110.755 -179.924 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.456 HG23 ' N ' ' A' ' 32' ' ' HIS . 9.5 t -78.42 -47.63 17.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.2 -179.759 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' HIS . . . . . 0.456 ' N ' HG23 ' A' ' 31' ' ' THR . 69.0 m-70 -152.1 -89.6 0.06 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.357 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.89 HD22 HG21 ' A' ' 53' ' ' ILE . 0.9 OUTLIER 60.86 151.44 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.131 0 N-CA-C 110.199 -0.297 . . . . 0.0 110.199 -179.45 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.5 HD11 ' HD3' ' A' ' 56' ' ' PRO . 3.6 mp -140.01 109.72 3.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 121.109 0.48 . . . . 0.0 111.986 -179.749 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 54.49 73.18 0.93 Allowed Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 115.554 -0.748 . . . . 0.0 112.159 179.03 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -75.5 151.62 37.55 Favored 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 122.45 2.1 . . . . 0.0 111.433 178.871 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -134.26 133.25 40.6 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.202 0.525 . . . . 0.0 111.907 -179.14 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.443 ' CD1' ' HB1' ' A' ' 51' ' ' ALA . 13.9 mm -121.47 132.21 71.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.64 179.531 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 37.9 mt -119.69 146.74 23.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.98 -179.883 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.647 HD22 HD11 ' A' ' 73' ' ' ILE . 2.2 mt -124.35 126.36 45.87 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.013 0.435 . . . . 0.0 110.842 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -123.02 -173.17 2.65 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.421 179.615 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.412 ' HA ' ' HA ' ' A' ' 47' ' ' PHE . 81.9 tttt -163.55 139.28 6.6 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.386 0.612 . . . . 0.0 111.285 -179.764 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -130.85 158.79 73.95 Favored Pre-proline 0 C--N 1.323 -0.554 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.382 179.137 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_exo -52.05 -24.31 19.4 Favored 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 121.957 1.772 . . . . 0.0 112.489 179.988 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.26 -6.03 57.12 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.506 -0.77 . . . . 0.0 112.689 -179.107 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 148.86 -161.02 28.59 Favored Glycine 0 C--O 1.223 -0.542 0 C-N-CA 120.299 -0.953 . . . . 0.0 112.159 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.423 ' CD1' ' N ' ' A' ' 47' ' ' PHE . 18.0 m-85 -111.35 155.11 23.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.516 0.674 . . . . 0.0 111.989 -179.908 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.781 HG22 ' CG ' ' A' ' 65' ' ' LYS . 94.0 t -127.41 139.44 51.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 114.844 -1.071 . . . . 0.0 111.01 -179.24 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.408 ' O ' ' HA ' ' A' ' 63' ' ' SER . . . -130.65 122.41 27.33 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.447 179.4 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -119.61 147.04 44.98 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.808 0.337 . . . . 0.0 111.115 -179.616 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.637 ' N ' HD11 ' A' ' 76' ' ' LEU . . . -143.56 139.43 29.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.207 179.719 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.0 m -135.95 130.54 33.84 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.294 179.674 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.89 HG21 HD22 ' A' ' 33' ' ' LEU . 23.4 mt -132.38 134.89 58.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 120.873 0.368 . . . . 0.0 111.215 -179.753 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.451 ' O ' HD12 ' A' ' 34' ' ' ILE . 9.3 m120 -103.02 119.41 38.8 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.978 179.625 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.508 HG22 HD23 ' A' ' 33' ' ' LEU . 33.3 p -112.44 157.09 41.11 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.406 179.541 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.5 ' HD3' HD11 ' A' ' 34' ' ' ILE . 24.2 Cg_exo -63.3 -14.25 40.89 Favored 'Trans proline' 0 C--N 1.342 0.227 0 C-N-CA 122.521 2.148 . . . . 0.0 112.643 -179.77 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 59.6 m-80 -117.77 24.17 11.23 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.463 -179.707 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 134.93 -167.58 23.98 Favored Glycine 0 C--N 1.331 0.262 0 C-N-CA 120.48 -0.867 . . . . 0.0 112.815 179.797 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.676 HG13 ' O ' ' A' ' 53' ' ' ILE . 14.1 t -138.92 142.47 34.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 120.703 0.287 . . . . 0.0 110.956 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 16.3 mt -116.5 151.21 36.56 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.033 -179.79 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 15.0 p -139.47 148.18 23.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.086 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.536 ' O ' HD12 ' A' ' 76' ' ' LEU . . . -154.5 149.59 26.9 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.132 0.491 . . . . 0.0 111.559 -179.721 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' SER . . . . . 0.408 ' HA ' ' O ' ' A' ' 49' ' ' ALA . 6.3 m -143.99 158.26 43.82 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.662 -179.437 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.658 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -150.48 105.34 0.29 Allowed Glycine 0 C--N 1.332 0.359 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.659 179.456 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.781 ' CG ' HG22 ' A' ' 48' ' ' VAL . 0.2 OUTLIER -103.75 45.04 0.98 Allowed 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.14 0.422 . . . . 0.0 112.14 -178.904 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.461 ' CE1' HG21 ' A' ' 71' ' ' THR . 12.5 t-80 -76.27 155.93 33.91 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.62 -0.264 . . . . 0.0 110.437 178.846 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -60.31 -28.0 67.77 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.587 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 7.2 t0 -98.29 120.13 38.17 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.957 0.408 . . . . 0.0 111.526 -179.308 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 24.2 ttt -48.05 -47.24 33.83 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.608 179.86 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -66.28 -41.21 90.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.101 -179.584 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.461 HG21 ' CE1' ' A' ' 66' ' ' HIS . 76.8 m -65.22 -37.22 86.6 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.416 -0.357 . . . . 0.0 110.613 179.779 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.658 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -63.08 -50.77 69.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.689 179.626 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.647 HD11 HD22 ' A' ' 40' ' ' LEU . 7.8 mt -62.08 -41.98 93.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 179.262 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -63.86 -39.86 95.2 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 178.937 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.439 ' HA ' ' HB3' ' A' ' 78' ' ' ASN . 5.3 mt-10 -66.88 -41.11 87.8 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.39 179.207 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.637 HD11 ' N ' ' A' ' 51' ' ' ALA . 0.2 OUTLIER -53.2 -61.65 2.16 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 178.838 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.784 HG21 ' HD3' ' A' ' 22' ' ' ARG . 52.2 mt -54.96 -30.27 23.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 178.502 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.439 ' HB3' ' HA ' ' A' ' 75' ' ' GLU . 0.0 OUTLIER -57.77 -38.48 75.51 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.065 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.14 -30.92 55.31 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 114.704 -1.135 . . . . 0.0 109.839 178.592 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.799 ' O ' HD12 ' A' ' 84' ' ' LEU . 67.7 mt -64.74 -49.15 71.94 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 107.987 -1.116 . . . . 0.0 107.987 177.608 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -59.71 -48.73 80.52 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.151 177.633 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 50.5 mtt-85 -64.3 -25.57 68.11 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.962 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -74.63 -48.57 25.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.354 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.799 HD12 ' O ' ' A' ' 80' ' ' LEU . 1.0 OUTLIER -64.5 -29.16 70.2 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.497 179.64 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 31.1 t-20 -61.54 -33.29 73.58 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.024 -0.535 . . . . 0.0 109.912 179.719 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.86 -26.49 61.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.362 179.423 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.19 -46.79 82.39 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.375 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 54.9 mt-30 -77.96 -13.19 59.97 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.864 179.302 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 81.0 m-70 62.57 -79.16 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.318 179.768 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 1.2 mmtt 61.46 155.17 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.718 -179.775 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 173.92 40.71 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.654 -0.784 . . . . 0.0 112.564 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -176.1 90.62 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.808 0.337 . . . . 0.0 110.94 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -59.33 112.98 1.94 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.132 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 22.9 mtp180 -67.71 -44.4 77.74 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.937 179.973 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -84.19 135.53 34.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.93 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -109.55 34.7 3.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.046 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -128.46 161.57 29.21 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.114 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 7.1 m -147.34 -57.47 0.25 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.933 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 20.5 m -123.8 125.72 45.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.966 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.534 ' O ' HG13 ' A' ' 100' ' ' VAL . 12.3 p -104.31 56.87 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.075 -179.975 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 59.92 27.06 16.37 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.995 179.988 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 56.85 103.16 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.031 179.986 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -69.89 -30.44 67.88 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.078 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 61.86 103.0 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.938 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 21.6 p90 -177.11 135.35 0.2 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.849 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.477 HG13 ' O ' ' A' ' 106' ' ' VAL . 11.6 p -176.08 120.8 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.177 179.965 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 62.75 120.73 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.923 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 46.27 -169.29 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.247 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 21.5 t -107.23 149.25 10.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.05 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -104.3 -31.79 9.39 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.843 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -71.38 79.53 0.75 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.887 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.219 -0.896 . . . . 0.0 110.916 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' THR . . . . . 0.508 ' O ' ' O ' ' A' ' 2' ' ' MET . 48.0 p . . . . . 0 N--CA 1.486 1.336 0 CA-C-O 120.563 0.221 . . . . 0.0 111.292 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' MET . . . . . 0.512 ' HG2' ' O ' ' A' ' 2' ' ' MET . 0.0 OUTLIER 51.03 126.88 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 121.444 0.64 . . . . 0.0 111.985 -179.911 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.454 HD21 ' CD2' ' A' ' 37' ' ' HIS . 12.7 t30 -120.02 97.58 5.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.276 -179.58 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.565 ' CG2' HD11 ' A' ' 40' ' ' LEU . 34.3 mt -97.04 124.89 50.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.645 179.455 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -134.44 159.9 39.64 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.953 0.406 . . . . 0.0 111.239 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.609 ' HB3' HD12 ' A' ' 40' ' ' LEU . 21.8 p -163.42 145.29 9.65 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.475 -179.766 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 20.8 mmtp -103.41 -6.04 22.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.576 -179.663 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -99.97 -28.21 13.19 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 120.747 0.308 . . . . 0.0 111.209 -179.848 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 37.9 mtm -140.14 -175.52 4.27 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.071 -179.874 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 -111.06 166.93 10.65 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.653 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 5.2 mm -89.97 108.98 20.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 121.101 0.477 . . . . 0.0 111.066 -179.567 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 17.1 p -97.53 154.66 37.88 Favored Pre-proline 0 C--N 1.326 -0.441 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.002 179.721 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_exo -59.54 -17.92 44.16 Favored 'Trans proline' 0 C--N 1.343 0.281 0 C-N-CA 122.466 2.111 . . . . 0.0 112.029 179.339 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.14 -43.48 17.72 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.883 0.373 . . . . 0.0 110.573 179.629 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.576 ' O ' HG23 ' A' ' 19' ' ' VAL . 27.8 mt -72.6 -27.5 25.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.577 179.086 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 17.4 ttm180 -75.6 -44.77 41.32 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.367 178.732 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -67.84 -39.18 83.87 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.698 179.031 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.523 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 78.2 t60 -60.34 -57.23 13.67 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.843 -0.428 . . . . 0.0 109.843 178.989 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.625 HG22 HG21 ' A' ' 73' ' ' ILE . 35.7 t -61.52 -47.68 92.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 120.778 0.323 . . . . 0.0 110.146 178.477 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.713 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -57.98 -42.34 84.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.958 179.755 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.523 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 0.9 OUTLIER -59.54 -35.21 73.77 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.118 0.485 . . . . 0.0 110.053 179.96 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.639 ' O ' HD12 ' A' ' 26' ' ' LEU . 25.5 mmm180 -76.24 -26.64 56.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.541 179.415 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.713 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 4.1 mt -68.09 -56.48 8.69 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.01 0.434 . . . . 0.0 110.298 179.484 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.65 -23.58 64.89 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.366 179.736 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.2 tmtm? -78.31 -30.98 48.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.107 0.479 . . . . 0.0 110.344 179.459 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.776 HD11 HG21 ' A' ' 77' ' ' ILE . 4.8 mt -80.26 56.0 2.37 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.649 179.556 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -55.4 -44.42 76.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.402 -179.634 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.454 ' HG2' ' NE1' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -94.01 20.0 8.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.547 -179.717 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.613 ' HB3' HD13 ' A' ' 84' ' ' LEU . 9.4 m95 -146.94 20.13 1.26 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.679 0.276 . . . . 0.0 110.947 -179.67 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.427 ' O ' ' N ' ' A' ' 32' ' ' HIS . 3.2 tp60 -125.29 -43.92 1.9 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.946 0.403 . . . . 0.0 110.19 179.467 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER 40.4 -89.06 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 115.535 -0.757 . . . . 0.0 112.027 179.646 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' HIS . . . . . 0.427 ' N ' ' O ' ' A' ' 30' ' ' GLN . 57.8 m-70 -127.14 -51.14 1.42 Allowed 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 111.873 0.323 . . . . 0.0 111.873 -179.468 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.867 HD22 HG21 ' A' ' 53' ' ' ILE . 21.2 mt 73.75 5.76 4.88 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 120.875 0.369 . . . . 0.0 111.123 -179.202 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.83 HG21 ' HB3' ' A' ' 54' ' ' ASN . 6.1 tt 34.15 34.05 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.261 0 N-CA-C 113.196 0.813 . . . . 0.0 113.196 179.428 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.454 ' CB ' ' O ' ' A' ' 34' ' ' ILE . 4.4 m120 77.45 77.37 0.15 Allowed Pre-proline 0 C--N 1.321 -0.65 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 -176.976 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.567 ' HB3' HG23 ' A' ' 53' ' ' ILE . 90.7 Cg_endo -80.72 173.16 12.45 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 123.244 2.63 . . . . 0.0 113.394 -178.951 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' HIS . . . . . 0.532 ' C ' HD12 ' A' ' 38' ' ' ILE . 0.2 OUTLIER -140.45 126.83 19.98 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.109 179.854 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.678 HD12 ' N ' ' A' ' 38' ' ' ILE . 3.0 mp -118.88 136.54 55.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.393 179.587 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 4.9 mt -121.06 148.64 24.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.566 -179.336 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.609 HD12 ' HB3' ' A' ' 6' ' ' SER . 1.3 mt -124.24 126.8 46.71 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.624 -0.717 . . . . 0.0 110.643 179.583 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 2.8 m -123.93 -174.26 2.94 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.507 179.898 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.412 ' HG3' ' CD2' ' A' ' 47' ' ' PHE . 11.0 tttm -160.95 140.71 10.79 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.424 0.631 . . . . 0.0 111.396 -179.845 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 65.2 mt-10 -131.41 162.15 57.74 Favored Pre-proline 0 C--N 1.322 -0.596 0 CA-C-N 115.026 -0.988 . . . . 0.0 109.305 179.347 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_endo -56.43 -25.7 59.12 Favored 'Trans proline' 0 N--CA 1.464 -0.229 0 C-N-CA 121.967 1.778 . . . . 0.0 111.95 179.621 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.09 -7.81 56.41 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.121 -0.945 . . . . 0.0 112.796 -179.059 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 150.52 -163.81 29.67 Favored Glycine 0 C--O 1.224 -0.522 0 C-N-CA 120.229 -0.986 . . . . 0.0 112.245 179.869 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.412 ' CD2' ' HG3' ' A' ' 42' ' ' LYS . 18.0 m-85 -108.87 154.85 21.54 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.499 0.666 . . . . 0.0 111.796 179.953 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.581 HG22 ' HG2' ' A' ' 65' ' ' LYS . 53.1 t -128.69 139.39 52.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 114.927 -1.033 . . . . 0.0 111.145 -179.27 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -130.42 123.91 30.89 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.525 179.441 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 28.7 m-20 -118.67 146.25 44.84 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.65 -0.25 . . . . 0.0 110.727 -179.845 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.609 ' CB ' HD11 ' A' ' 76' ' ' LEU . . . -145.66 140.64 27.45 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.724 -0.39 . . . . 0.0 111.484 179.8 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.407 HG23 HG22 ' A' ' 61' ' ' VAL . 3.0 m -134.59 128.96 34.23 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 179.102 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.867 HG21 HD22 ' A' ' 33' ' ' LEU . 21.4 mt -133.75 139.34 48.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 C-N-CA 120.724 -0.391 . . . . 0.0 111.852 -179.277 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.83 ' HB3' HG21 ' A' ' 34' ' ' ILE . 0.9 OUTLIER -99.86 145.38 27.83 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.85 179.116 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.416 ' HB ' ' HD2' ' A' ' 56' ' ' PRO . 18.9 p -138.76 158.85 69.35 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.502 179.261 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.416 ' HD2' ' HB ' ' A' ' 55' ' ' THR . 60.6 Cg_endo -73.96 -1.41 10.82 Favored 'Trans proline' 0 N--CA 1.463 -0.31 0 C-N-CA 121.772 1.648 . . . . 0.0 112.729 -179.243 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -126.5 2.39 6.91 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.567 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 162.31 -164.8 35.74 Favored Glycine 0 C--N 1.333 0.363 0 C-N-CA 120.405 -0.902 . . . . 0.0 112.925 -179.993 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 21.3 t -132.8 148.16 31.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.802 0.334 . . . . 0.0 111.083 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.417 HD11 HD21 ' A' ' 84' ' ' LEU . 14.1 mt -121.09 136.01 55.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.428 -179.672 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.407 HG22 HG23 ' A' ' 52' ' ' THR . 21.3 t -140.69 137.29 35.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.657 179.657 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.57 ' O ' HD12 ' A' ' 76' ' ' LEU . . . -153.09 155.86 37.6 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.279 0.561 . . . . 0.0 111.892 -179.418 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 88.8 p -143.98 157.41 44.35 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.252 -0.885 . . . . 0.0 111.682 -179.31 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.797 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -150.92 99.64 0.2 Allowed Glycine 0 C--N 1.332 0.323 0 CA-C-N 115.833 -0.622 . . . . 0.0 111.559 179.461 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.581 ' HG2' HG22 ' A' ' 48' ' ' VAL . 59.9 mttt -100.83 44.57 1.01 Allowed 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -178.966 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 12.4 t-80 -75.66 155.31 35.89 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.256 178.709 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -60.46 -26.81 67.06 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.685 0.278 . . . . 0.0 111.29 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -97.09 116.7 29.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.99 0.424 . . . . 0.0 111.329 -179.449 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.7 tmt? -47.57 -46.42 28.01 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.665 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 -66.48 -41.41 89.01 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.31 -179.534 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 35.4 m -65.41 -37.67 87.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.787 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.797 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -61.88 -51.54 67.77 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.822 179.782 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.625 HG21 HG22 ' A' ' 19' ' ' VAL . 7.7 mt -61.64 -42.5 94.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 120.84 0.352 . . . . 0.0 110.319 179.561 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -63.67 -40.2 96.24 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.109 179.253 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -66.47 -42.58 87.32 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.635 179.413 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.609 HD11 ' CB ' ' A' ' 51' ' ' ALA . 0.2 OUTLIER -52.55 -60.94 2.63 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 179.3 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.776 HG21 HD11 ' A' ' 26' ' ' LEU . 21.9 mt -56.66 -30.29 31.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 178.706 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -59.19 -29.06 67.2 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-O 121.272 0.558 . . . . 0.0 109.974 178.069 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.46 ' HB2' ' HB1' ' A' ' 62' ' ' ALA . 1.2 mptt -86.49 -29.32 22.84 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.384 179.184 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.695 ' O ' HD12 ' A' ' 84' ' ' LEU . 84.1 mt -63.14 -49.76 73.09 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 177.671 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.46 ' HG3' ' CG ' ' A' ' 29' ' ' TRP . 4.1 tt0 -60.04 -46.44 89.51 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 114.926 -1.033 . . . . 0.0 110.416 177.759 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.51 -33.86 75.74 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.317 -179.506 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.427 HE22 ' HB2' ' A' ' 62' ' ' ALA . 37.0 mt-30 -74.73 -42.36 58.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.836 0.351 . . . . 0.0 110.451 179.765 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.695 HD12 ' O ' ' A' ' 80' ' ' LEU . 1.5 mt -65.05 -29.26 70.14 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.61 179.523 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ASN . . . . . 0.435 ' O ' ' HG3' ' A' ' 88' ' ' GLN . 2.4 t-20 -61.81 -49.26 77.05 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.133 0.492 . . . . 0.0 110.256 179.936 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.465 ' HA ' ' CD2' ' A' ' 89' ' ' HIS . 0.1 OUTLIER -76.69 -20.65 56.36 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.974 179.519 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.568 HD23 ' C ' ' A' ' 87' ' ' LEU . 9.2 tt -71.31 -36.07 71.49 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -179.002 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.435 ' HG3' ' O ' ' A' ' 85' ' ' ASN . 0.4 OUTLIER -76.43 -99.26 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 111.74 0.274 . . . . 0.0 111.74 -178.797 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.465 ' CD2' ' HA ' ' A' ' 86' ' ' LYS . 70.5 m-70 50.95 -91.34 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.788 0.328 . . . . 0.0 110.89 -179.381 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 68.66 -71.57 0.11 Allowed 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.06 179.661 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 140.79 -28.18 2.42 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.316 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -155.47 52.33 0.59 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.829 0.347 . . . . 0.0 110.772 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -80.78 65.3 5.87 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.158 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.31 27.22 0.3 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.909 179.846 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 177.29 90.81 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.66 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -122.9 -66.86 0.99 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.195 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . 60.06 163.21 0.05 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.016 -179.926 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -103.5 -58.66 1.84 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.897 179.976 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -158.48 113.44 2.58 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.779 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.573 HG23 ' O ' ' A' ' 100' ' ' VAL . 27.7 m -66.86 108.51 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.152 -179.968 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 30.2 mttt -121.26 173.28 7.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.898 179.938 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -113.91 178.92 4.11 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.973 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.519 ' HB1' ' CG2' ' A' ' 106' ' ' VAL . . . -161.62 141.38 10.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.144 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 49.8 m-80 -146.01 142.13 28.34 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.831 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 60.42 31.2 20.29 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.827 179.975 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 106' ' ' VAL . . . . . 0.56 ' O ' HG23 ' A' ' 106' ' ' VAL . 17.1 m -136.97 98.6 1.67 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.14 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -76.38 154.77 34.63 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.859 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 19.6 pt-20 -68.18 125.93 27.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.894 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 12.3 p -109.55 145.1 16.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.117 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -84.6 100.26 11.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.852 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 62.31 149.96 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.912 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.243 -0.884 . . . . 0.0 110.914 179.965 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . 0.698 ' HG3' HD11 ' A' ' 23' ' ' LEU . 8.2 ttp . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.736 0.303 . . . . 0.0 110.826 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -119.52 122.97 42.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.078 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.421 ' CG2' HD11 ' A' ' 40' ' ' LEU . 36.9 mt -120.68 125.54 74.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.849 179.76 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -134.02 160.71 36.92 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.862 0.363 . . . . 0.0 111.119 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.41 ' HB3' ' HB2' ' A' ' 40' ' ' LEU . 44.8 p -163.43 142.67 8.34 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.637 -179.533 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -102.47 31.25 4.15 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.002 -179.571 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -140.95 -48.0 0.41 Allowed 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.647 179.623 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -119.32 -174.29 2.69 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.638 179.72 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -114.33 167.63 10.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.618 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 5.0 mm -91.2 115.56 30.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.109 0.481 . . . . 0.0 111.085 -179.502 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.419 ' H ' HD12 ' A' ' 15' ' ' ILE . 15.4 p -99.74 149.33 35.83 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.887 179.75 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_exo -56.39 -19.64 29.47 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.335 2.023 . . . . 0.0 111.919 179.216 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -77.75 -41.6 37.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.078 0.466 . . . . 0.0 110.284 179.234 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.428 ' O ' HG23 ' A' ' 19' ' ' VAL . 22.9 mt -73.23 -29.1 27.22 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.367 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.517 178.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 13.3 ttp85 -74.12 -45.74 47.02 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.604 -0.726 . . . . 0.0 109.227 178.722 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 33.8 tt0 -67.46 -37.35 82.8 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.503 178.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.494 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 72.5 t60 -59.2 -62.49 1.85 Allowed 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 178.872 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.89 HG13 HD11 ' A' ' 77' ' ' ILE . 22.2 t -60.65 -46.56 95.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.609 -0.268 . . . . 0.0 110.536 178.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.678 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -57.06 -43.94 82.53 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.846 179.746 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.494 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 1.1 p30 -59.66 -33.34 71.42 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.95 0.405 . . . . 0.0 110.645 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 10.3 mmt180 -74.67 -28.16 60.72 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.058 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.698 HD11 ' HG3' ' A' ' 2' ' ' MET . 2.4 mt -67.53 -52.77 34.94 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.151 0.5 . . . . 0.0 110.293 179.453 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.48 -25.45 66.06 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.217 179.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.94 -28.28 43.72 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.934 179.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.66 HD12 ' HA ' ' A' ' 23' ' ' LEU . 5.8 mt . . . . . 0 C--N 1.328 -0.361 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.0 -179.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.825 ' HB3' HD12 ' A' ' 53' ' ' ILE . 77.0 Cg_endo . . . . . 0 N--CA 1.464 -0.233 0 CA-C-O 120.768 0.237 . . . . 0.0 111.958 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -136.84 130.05 31.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.233 -179.66 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.64 ' N ' HD12 ' A' ' 38' ' ' ILE . 3.4 mp -121.46 134.6 64.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.855 179.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 4.1 mp -116.95 146.04 21.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.999 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.507 HD21 HG12 ' A' ' 73' ' ' ILE . 1.8 mt -122.31 128.32 50.91 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.054 0.454 . . . . 0.0 111.023 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 5.3 m -123.99 -173.55 2.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.301 179.6 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.425 ' HG3' ' CD2' ' A' ' 47' ' ' PHE . 3.0 tttp -158.58 141.29 14.46 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.372 0.606 . . . . 0.0 111.43 -179.678 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -131.82 156.37 80.2 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-N 115.075 -0.966 . . . . 0.0 109.146 179.232 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_exo -51.73 -24.42 17.92 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 121.881 1.721 . . . . 0.0 112.382 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.72 -6.84 55.66 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.47 -0.786 . . . . 0.0 112.808 -179.148 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 149.68 -164.15 29.44 Favored Glycine 0 C--O 1.224 -0.501 0 C-N-CA 120.153 -1.022 . . . . 0.0 112.161 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.425 ' CD2' ' HG3' ' A' ' 42' ' ' LYS . 18.0 m-85 -108.19 152.63 24.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.544 0.688 . . . . 0.0 112.015 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.695 HG22 ' HG2' ' A' ' 65' ' ' LYS . 53.2 t -127.55 142.01 44.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 114.753 -1.112 . . . . 0.0 110.96 -179.23 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -132.45 124.88 29.45 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.986 179.666 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -117.7 149.5 40.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.436 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.64 ' N ' HD11 ' A' ' 76' ' ' LEU . . . -146.02 142.06 28.26 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.905 0.383 . . . . 0.0 111.798 -179.728 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.728 ' O ' HD13 ' A' ' 53' ' ' ILE . 4.4 m -134.35 134.04 41.33 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.278 179.651 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.825 HD12 ' HB3' ' A' ' 36' ' ' PRO . 3.4 mm -132.54 133.29 59.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.979 0.418 . . . . 0.0 111.16 -179.69 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 13.5 m-20 -102.98 130.86 50.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.427 179.02 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 7.3 p -128.6 165.74 29.38 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.749 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_exo -69.87 -8.98 24.96 Favored 'Trans proline' 0 CA--C 1.529 0.247 0 C-N-CA 122.703 2.269 . . . . 0.0 112.55 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -123.08 22.91 9.41 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 111.694 0.257 . . . . 0.0 111.694 -179.632 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 132.77 -167.42 23.23 Favored Glycine 0 C--N 1.331 0.255 0 C-N-CA 120.441 -0.885 . . . . 0.0 112.938 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.662 HG13 ' O ' ' A' ' 53' ' ' ILE . 14.9 t -136.43 143.48 35.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.813 0.339 . . . . 0.0 110.943 -179.853 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.9 mt -115.55 155.72 27.05 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.981 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 21.4 t -140.19 148.03 22.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.312 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.439 ' HB1' ' HB2' ' A' ' 79' ' ' LYS . . . -153.73 146.52 24.33 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.045 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -146.16 155.72 42.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.744 -179.442 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.462 ' O ' HG13 ' A' ' 48' ' ' VAL . . . -142.85 154.49 25.34 Favored Glycine 0 N--CA 1.452 -0.277 0 N-CA-C 111.181 -0.768 . . . . 0.0 111.181 179.128 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.695 ' HG2' HG22 ' A' ' 48' ' ' VAL . 19.6 mttt -147.59 42.92 1.08 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 117.239 0.519 . . . . 0.0 112.018 -179.336 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.629 ' ND1' HG21 ' A' ' 71' ' ' THR . 12.8 t-80 -76.06 154.96 35.25 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.303 178.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -60.96 -26.14 67.32 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.727 0.299 . . . . 0.0 111.165 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -98.5 121.94 41.07 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.044 0.45 . . . . 0.0 111.433 -179.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.9 ttt -48.33 -49.18 35.17 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.802 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 42.2 m-85 -65.75 -37.6 86.83 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.44 -179.242 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.629 HG21 ' ND1' ' A' ' 66' ' ' HIS . 93.6 m -64.85 -40.42 95.14 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.792 0.329 . . . . 0.0 110.613 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.82 -48.28 81.31 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.624 179.552 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.507 HG12 HD21 ' A' ' 40' ' ' LEU . 10.3 mt -60.52 -43.0 93.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.839 0.352 . . . . 0.0 110.181 179.384 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -65.21 -39.65 93.08 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.212 179.099 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -66.64 -45.61 78.46 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.728 179.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.64 HD11 ' N ' ' A' ' 51' ' ' ALA . 0.2 OUTLIER -53.42 -61.09 2.52 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.554 -0.294 . . . . 0.0 110.284 179.479 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.89 HD11 HG13 ' A' ' 19' ' ' VAL . 62.4 mt -55.37 -28.19 21.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 C-N-CA 120.899 -0.32 . . . . 0.0 110.201 179.086 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -58.99 -38.0 78.15 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 177.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.439 ' HB2' ' HB1' ' A' ' 62' ' ' ALA . 0.0 OUTLIER -73.25 -30.22 63.31 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 114.755 -1.112 . . . . 0.0 109.849 178.69 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 84.1 mt -63.31 -48.63 77.27 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 177.511 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -61.69 -49.44 76.46 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 114.625 -1.171 . . . . 0.0 110.52 177.801 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.07 -27.27 69.28 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.157 -179.77 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -75.38 -44.49 44.57 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.932 0.396 . . . . 0.0 110.686 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 3.5 mt -64.2 -26.46 68.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.71 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -63.6 -41.48 98.32 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.192 179.653 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 17.5 mmtt . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.285 179.907 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.7 tmt? . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.865 0.364 . . . . 0.0 110.906 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . 0.401 ' OD1' ' CE1' ' A' ' 37' ' ' HIS . 3.3 t-20 -127.76 109.38 11.59 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.278 -179.631 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.844 HG22 ' HB ' ' A' ' 38' ' ' ILE . 7.7 pt -118.19 128.66 75.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.702 179.561 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.551 ' HA ' HD11 ' A' ' 11' ' ' ILE . 2.9 p -134.0 165.85 24.07 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.229 -179.771 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.469 ' HB3' HD12 ' A' ' 40' ' ' LEU . 21.7 p -163.51 144.47 9.12 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.24 -179.787 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.77 -2.67 27.66 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.67 -179.54 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -98.85 -29.44 12.96 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 120.705 0.288 . . . . 0.0 111.041 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 34.6 mtm -143.41 178.79 7.51 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.032 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -98.74 163.88 12.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.69 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.632 HG22 ' HG3' ' A' ' 16' ' ' ARG . 5.0 mm -90.67 116.68 32.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.052 0.453 . . . . 0.0 111.05 -179.543 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 15.1 p -100.52 158.47 31.86 Favored Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.959 179.771 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_exo -63.32 -14.65 43.41 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.519 2.146 . . . . 0.0 111.911 179.091 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -84.49 -41.24 16.76 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-O 121.012 0.434 . . . . 0.0 110.434 179.507 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 34.6 mt -72.95 -30.5 32.44 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.299 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.284 178.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.674 ' HA ' HD11 ' A' ' 4' ' ' ILE . 47.3 mtp180 -71.67 -47.11 56.45 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.502 178.551 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 19.4 tt0 -67.18 -36.07 80.99 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.557 178.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.457 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 56.6 t60 -60.13 -64.56 0.91 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.951 0.405 . . . . 0.0 110.025 178.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.698 HG12 HD21 ' A' ' 23' ' ' LEU . 23.3 t -61.34 -47.1 95.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.9 179.128 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.66 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -56.44 -47.06 79.9 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 111.751 0.278 . . . . 0.0 111.751 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.457 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 3.2 p30 -59.83 -29.1 68.04 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.705 -0.398 . . . . 0.0 110.447 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 17.2 mmm180 -75.7 -29.85 59.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.591 179.41 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.698 HD21 HG12 ' A' ' 19' ' ' VAL . 1.3 mt -68.17 -50.62 53.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.942 0.401 . . . . 0.0 110.272 179.183 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.33 -24.32 63.25 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.803 179.467 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 29.4 tttt -78.1 -32.49 50.58 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.409 179.238 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.481 HD11 ' CG2' ' A' ' 77' ' ' ILE . 0.5 OUTLIER . . . . . 0 C--N 1.33 -0.25 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.757 179.542 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.5 ' HB3' HG23 ' A' ' 53' ' ' ILE . 86.3 Cg_endo . . . . . 0 N--CA 1.462 -0.328 0 N-CA-C 111.326 -0.298 . . . . 0.0 111.326 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . 0.401 ' CE1' ' OD1' ' A' ' 3' ' ' ASN . 1.6 t-160 -134.0 128.43 34.36 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.123 0.487 . . . . 0.0 111.612 -179.397 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.844 ' HB ' HG22 ' A' ' 4' ' ' ILE . 3.4 mp -120.73 135.63 60.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.594 179.491 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 26.5 mt -115.78 146.44 20.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.937 0.399 . . . . 0.0 111.254 -179.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.469 HD12 ' HB3' ' A' ' 6' ' ' SER . 2.9 mt -119.86 128.68 53.89 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.808 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 9.2 m -125.5 -170.46 2.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.733 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.487 ' HA ' ' HA ' ' A' ' 47' ' ' PHE . 3.6 ttpm? -173.29 145.96 1.35 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.186 0.517 . . . . 0.0 110.762 -179.812 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.443 ' HB3' ' HD2' ' A' ' 44' ' ' PRO . 5.5 mt-10 -131.0 170.47 11.15 Favored Pre-proline 0 C--N 1.324 -0.504 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.213 179.043 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . 0.443 ' HD2' ' HB3' ' A' ' 43' ' ' GLU . 69.0 Cg_exo -51.62 -19.34 7.31 Favored 'Trans proline' 0 N--CA 1.463 -0.282 0 C-N-CA 121.786 1.658 . . . . 0.0 112.354 -179.332 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.01 -78.71 0.27 Allowed 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.905 179.094 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . 0.404 ' HA3' ' HA ' ' A' ' 67' ' ' GLU . . . -141.16 -154.6 6.24 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.665 -179.281 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.487 ' HA ' ' HA ' ' A' ' 42' ' ' LYS . 20.1 m-85 -109.6 151.33 26.96 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 121.623 0.725 . . . . 0.0 112.726 -179.437 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.657 HG22 ' CG ' ' A' ' 65' ' ' LYS . 54.9 t -124.61 142.93 39.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 114.511 -1.222 . . . . 0.0 110.48 -179.888 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -132.9 126.08 31.33 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.238 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.419 ' O ' HG23 ' A' ' 38' ' ' ILE . 1.6 m-20 -118.92 150.28 40.17 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.583 179.713 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.645 ' HB2' HD21 ' A' ' 76' ' ' LEU . . . -146.8 141.14 26.37 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.845 0.355 . . . . 0.0 111.657 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.2 m -135.79 130.83 34.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.024 179.45 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.664 ' O ' HG13 ' A' ' 59' ' ' VAL . 13.4 mt -133.02 138.03 52.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 121.102 0.477 . . . . 0.0 111.785 -179.69 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 19.9 m-20 -102.05 119.25 38.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.723 179.362 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 10.6 p -112.23 156.3 42.24 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.453 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -63.48 -14.21 41.02 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 122.484 2.123 . . . . 0.0 112.619 -179.776 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 9.1 m120 -119.69 23.4 11.16 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.628 -0.26 . . . . 0.0 111.538 -179.644 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 137.07 -166.95 24.82 Favored Glycine 0 N--CA 1.453 -0.175 0 C-N-CA 120.488 -0.863 . . . . 0.0 112.902 179.791 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.664 HG13 ' O ' ' A' ' 53' ' ' ILE . 15.0 t -135.91 142.91 37.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.828 0.347 . . . . 0.0 111.037 -179.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 37.0 mt -116.98 152.75 33.94 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.11 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 21.5 t -139.91 146.78 24.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.067 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.6 ' HB2' HE22 ' A' ' 83' ' ' GLN . . . -153.58 150.64 28.88 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.074 0.464 . . . . 0.0 111.205 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 94.3 p -145.69 156.17 43.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.73 -179.212 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.422 ' O ' ' HA ' ' A' ' 48' ' ' VAL . . . -144.39 146.91 17.83 Favored Glycine 0 C--N 1.331 0.302 0 N-CA-C 111.06 -0.816 . . . . 0.0 111.06 179.034 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.657 ' CG ' HG22 ' A' ' 48' ' ' VAL . 8.1 mttt -141.21 43.8 1.78 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 117.212 0.506 . . . . 0.0 112.056 -178.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.609 ' ND1' HG21 ' A' ' 71' ' ' THR . 12.9 t-80 -76.8 155.3 33.17 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.794 0.33 . . . . 0.0 110.436 178.887 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.404 ' HA ' ' HA3' ' A' ' 46' ' ' GLY . 21.2 mt-10 -61.13 -26.66 67.84 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.323 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -97.93 123.62 42.0 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.027 0.441 . . . . 0.0 111.45 -179.34 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.3 ttt -48.06 -50.15 29.0 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.774 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 72.6 m-85 -66.32 -38.29 87.35 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.672 -179.037 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.609 HG21 ' ND1' ' A' ' 66' ' ' HIS . 87.2 m -64.51 -42.57 95.73 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.698 0.285 . . . . 0.0 110.82 -179.775 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.09 -47.42 86.38 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.516 179.575 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.521 HG21 HG22 ' A' ' 19' ' ' VAL . 13.0 mt -60.13 -45.39 95.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 120.959 0.409 . . . . 0.0 110.311 179.459 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -64.62 -39.0 92.92 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.364 179.475 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -65.24 -43.59 90.9 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.412 179.46 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.645 HD21 ' HB2' ' A' ' 51' ' ' ALA . 0.2 OUTLIER -54.35 -57.34 11.64 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 179.065 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.577 HG13 HD23 ' A' ' 76' ' ' LEU . 8.7 mt -57.53 -30.58 36.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 N-CA-C 110.104 -0.332 . . . . 0.0 110.104 178.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -57.97 -37.78 74.82 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.561 0.696 . . . . 0.0 109.38 178.391 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -75.11 -28.9 60.41 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.708 -1.133 . . . . 0.0 109.935 178.873 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.483 HD12 ' HA ' ' A' ' 77' ' ' ILE . 99.3 mt -62.74 -49.45 74.98 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 177.424 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -62.29 -43.87 97.83 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 114.53 -1.214 . . . . 0.0 110.511 177.646 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 1.4 ptt180 -62.4 -34.61 77.07 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.638 -179.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.6 HE22 ' HB2' ' A' ' 62' ' ' ALA . 38.5 mt-30 -74.52 -39.22 62.51 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.478 179.57 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 19.3 mt -65.78 -26.01 67.51 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.846 179.581 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -63.93 -42.39 97.36 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.583 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.326 -0.426 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.051 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . 0.729 ' HG3' HD11 ' A' ' 23' ' ' LEU . 1.9 tmm? . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.782 0.325 . . . . 0.0 110.862 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -121.01 111.13 17.09 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.142 -179.819 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 45.8 mt -110.68 125.6 67.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.848 179.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.8 p -134.04 160.58 37.31 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.123 179.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.431 ' HB3' ' HB2' ' A' ' 40' ' ' LEU . 39.3 p -163.5 140.54 7.25 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.462 -179.557 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.1 mttp -101.13 33.62 2.8 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.032 -179.615 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -140.62 -50.39 0.45 Allowed 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.53 179.584 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 7.7 mtm -120.6 -174.45 2.81 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.606 179.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -111.62 171.84 7.25 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.766 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.8 mm -90.93 112.6 25.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 121.063 0.459 . . . . 0.0 111.054 -179.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 15.9 p -98.69 153.05 38.09 Favored Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.886 179.608 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_exo -58.61 -17.1 33.38 Favored 'Trans proline' 0 C--N 1.345 0.342 0 C-N-CA 122.379 2.052 . . . . 0.0 111.879 179.139 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.34 -42.53 20.4 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-O 121.022 0.439 . . . . 0.0 110.44 179.399 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.474 ' O ' HG23 ' A' ' 19' ' ' VAL . 36.1 mt -72.81 -28.34 26.97 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 CA-C-N 115.747 -0.661 . . . . 0.0 109.376 178.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 1.8 mmm180 -75.2 -46.27 35.05 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.627 178.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 51.9 tp60 -67.72 -38.53 83.73 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.714 179.096 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.491 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 81.2 t60 -60.11 -61.43 2.61 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 179.049 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.61 HG12 HD21 ' A' ' 23' ' ' LEU . 29.7 t -60.75 -47.01 95.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 116.622 -0.263 . . . . 0.0 110.552 178.909 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.678 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -57.52 -42.64 83.21 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 111.753 0.279 . . . . 0.0 111.753 179.702 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.491 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 1.0 OUTLIER -59.96 -33.28 71.71 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 120.64 -0.424 . . . . 0.0 110.287 179.916 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 27.2 mmt180 -75.02 -28.03 60.32 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.056 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.729 HD11 ' HG3' ' A' ' 2' ' ' MET . 3.6 mt -68.85 -54.05 17.92 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.004 0.43 . . . . 0.0 110.408 179.397 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.62 -24.31 63.71 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.813 -0.631 . . . . 0.0 111.188 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -79.5 -30.88 42.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.112 0.482 . . . . 0.0 110.286 179.41 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 37.2 mt . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.793 179.987 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.593 ' HB3' HG23 ' A' ' 53' ' ' ILE . 89.6 Cg_endo . . . . . 0 N--CA 1.462 -0.375 0 N-CA-C 111.279 -0.316 . . . . 0.0 111.279 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . 0.487 ' O ' HD13 ' A' ' 38' ' ' ILE . 0.5 OUTLIER -109.7 132.46 54.12 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.119 0.485 . . . . 0.0 112.153 -178.904 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.701 HD12 ' CB ' ' A' ' 51' ' ' ALA . 10.8 mm -121.51 133.3 68.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.263 179.232 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.529 ' C ' HD22 ' A' ' 40' ' ' LEU . 3.8 mt -123.77 139.2 51.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 120.981 0.419 . . . . 0.0 111.5 -179.375 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.609 HD11 HG12 ' A' ' 73' ' ' ILE . 3.2 mm? -116.93 128.1 54.88 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.727 179.844 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.2 m -124.2 -175.2 3.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.6 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.436 ' HG3' ' CD2' ' A' ' 47' ' ' PHE . 13.5 tttm -158.4 140.15 13.73 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.365 0.602 . . . . 0.0 111.157 -179.558 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 60.1 mt-10 -131.5 156.11 80.56 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 115.105 -0.952 . . . . 0.0 109.313 179.19 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_exo -51.5 -24.67 17.3 Favored 'Trans proline' 0 N--CA 1.464 -0.24 0 C-N-CA 121.906 1.737 . . . . 0.0 112.435 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -89.61 -6.69 56.01 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.437 -0.801 . . . . 0.0 112.749 -179.122 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 150.36 -163.9 29.64 Favored Glycine 0 C--O 1.225 -0.443 0 C-N-CA 120.227 -0.987 . . . . 0.0 112.275 179.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.436 ' CD2' ' HG3' ' A' ' 42' ' ' LYS . 18.9 m-85 -109.07 154.43 22.26 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.559 0.695 . . . . 0.0 111.987 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.555 HG22 ' HG2' ' A' ' 65' ' ' LYS . 68.0 t -127.94 139.57 51.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 114.787 -1.097 . . . . 0.0 110.941 -179.391 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -131.14 124.06 29.89 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.597 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -120.08 147.03 45.36 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.658 0.266 . . . . 0.0 110.986 -179.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.701 ' CB ' HD12 ' A' ' 38' ' ' ILE . . . -144.35 140.92 29.39 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.829 0.347 . . . . 0.0 111.387 179.738 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.0 m -136.33 131.3 34.13 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.253 179.469 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.593 HG23 ' HB3' ' A' ' 36' ' ' PRO . 15.3 mt -132.45 135.59 57.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 120.865 0.364 . . . . 0.0 111.252 -179.604 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -104.11 121.16 42.65 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.648 179.372 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 7.6 p -116.29 155.03 48.83 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.622 179.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_exo -65.33 -11.92 32.44 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.515 2.143 . . . . 0.0 112.528 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 8.5 m-80 -112.37 -4.3 14.31 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 111.732 0.271 . . . . 0.0 111.732 -179.697 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 162.32 -166.98 36.72 Favored Glycine 0 C--N 1.331 0.27 0 C-N-CA 120.388 -0.91 . . . . 0.0 112.82 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 34.8 t -129.98 140.36 49.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 120.835 0.35 . . . . 0.0 111.134 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -118.34 142.58 47.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.818 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.435 ' O ' ' NE2' ' A' ' 83' ' ' GLN . 11.1 p -140.67 146.61 23.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.935 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.513 ' O ' HD12 ' A' ' 76' ' ' LEU . . . -155.85 152.68 28.66 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.265 0.555 . . . . 0.0 111.698 -179.798 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 67.1 m -143.23 160.46 40.43 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.709 -179.347 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.7 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -155.18 105.77 0.28 Allowed Glycine 0 CA--C 1.519 0.289 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.566 179.548 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.555 ' HG2' HG22 ' A' ' 48' ' ' VAL . 1.1 mtmp? -107.73 44.47 1.09 Allowed 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.1 0.408 . . . . 0.0 112.1 -178.812 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 14.6 t-80 -75.72 156.33 34.78 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.578 -0.283 . . . . 0.0 110.415 178.598 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -60.07 -27.28 66.84 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.673 0.273 . . . . 0.0 111.199 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -98.33 120.46 38.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.944 0.402 . . . . 0.0 111.475 -179.438 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . 0.439 ' O ' HD12 ' A' ' 73' ' ' ILE . 13.3 ttt -48.2 -46.72 35.4 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.591 179.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 44.3 m-85 -66.47 -40.97 89.63 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.293 -179.418 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 86.8 m -65.26 -38.68 91.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.746 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.7 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -62.13 -50.71 70.8 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.8 179.607 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.609 HG12 HD11 ' A' ' 40' ' ' LEU . 7.0 mt -61.53 -43.78 97.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.788 0.327 . . . . 0.0 110.352 179.543 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -63.52 -40.25 96.55 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.246 179.339 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.12 -42.68 88.84 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.381 179.367 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.565 HD11 ' N ' ' A' ' 51' ' ' ALA . 0.2 OUTLIER -52.19 -62.0 1.91 Allowed 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 109.881 -0.415 . . . . 0.0 109.881 179.036 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 46.3 mt -55.05 -30.29 23.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 178.71 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -59.55 -29.58 68.02 Favored 'General case' 0 N--CA 1.442 -0.856 0 CA-C-O 121.22 0.533 . . . . 0.0 110.298 178.188 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.98 -28.34 22.73 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.354 179.155 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.786 ' O ' HD12 ' A' ' 84' ' ' LEU . 97.3 mt -63.7 -50.31 69.69 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 177.737 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -60.0 -50.67 72.83 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 114.907 -1.042 . . . . 0.0 111.057 177.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.52 -32.63 73.6 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.898 -179.349 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.435 ' NE2' ' O ' ' A' ' 61' ' ' VAL . 41.4 mt-30 -74.2 -42.54 59.63 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.619 179.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.786 HD12 ' O ' ' A' ' 80' ' ' LEU . 1.6 mt -65.55 -29.2 69.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.462 179.464 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -63.25 -28.25 69.9 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.568 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 25.9 mmtt . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.249 -179.818 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . 0.584 ' HG2' HD11 ' A' ' 23' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.459 0.023 0 CA-C-O 120.83 0.348 . . . . 0.0 110.978 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -122.38 112.98 18.75 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.392 -179.7 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.468 HG22 ' CD1' ' A' ' 11' ' ' ILE . 34.8 mt -109.97 126.75 67.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.539 179.419 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -134.38 162.25 32.75 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.862 0.363 . . . . 0.0 111.133 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 38.9 p -164.36 136.27 4.63 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.548 -179.739 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.6 mtpp -102.33 18.68 20.4 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.195 -179.737 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -141.72 20.61 2.17 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 120.881 0.372 . . . . 0.0 110.927 179.465 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 177.31 -177.99 0.18 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.545 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -117.84 160.22 21.77 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.855 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.468 ' CD1' HG22 ' A' ' 4' ' ' ILE . 3.4 mm -92.28 118.54 38.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.012 -179.746 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.492 ' H ' HD12 ' A' ' 15' ' ' ILE . 13.7 p -100.11 149.87 36.39 Favored Pre-proline 0 C--N 1.326 -0.424 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.701 179.528 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -56.23 -18.99 25.84 Favored 'Trans proline' 0 C--N 1.343 0.288 0 C-N-CA 122.4 2.067 . . . . 0.0 112.131 179.405 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.78 -39.93 25.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.069 0.461 . . . . 0.0 110.443 179.485 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.492 HD12 ' H ' ' A' ' 12' ' ' THR . 21.5 mt -72.93 -31.69 36.86 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.216 178.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.422 ' O ' ' CB ' ' A' ' 20' ' ' ALA . 0.2 OUTLIER -72.14 -47.37 51.49 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.537 178.854 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -66.94 -35.6 80.35 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.535 178.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.428 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 79.4 t60 -58.65 -65.27 0.69 Allowed 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 178.831 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.955 HG13 HD11 ' A' ' 77' ' ' ILE . 20.3 t -61.2 -46.17 97.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.819 178.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.616 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -55.37 -49.85 71.23 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 111.782 0.29 . . . . 0.0 111.782 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.428 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 3.2 p30 -58.58 -29.16 66.21 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.815 0.34 . . . . 0.0 110.709 -179.709 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.572 ' O ' HD12 ' A' ' 26' ' ' LEU . 41.9 mmt180 -75.14 -28.66 60.24 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.575 179.337 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.702 HD21 HG12 ' A' ' 19' ' ' VAL . 1.1 mt -69.41 -49.6 53.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.985 0.421 . . . . 0.0 110.529 179.148 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.35 -28.03 66.47 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.168 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.1 ttmm -79.53 -32.73 42.3 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.96 0.41 . . . . 0.0 110.587 179.356 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.572 HD12 ' O ' ' A' ' 22' ' ' ARG . 5.4 mt . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.782 179.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo . . . . . 0 C--O 1.231 0.174 0 CA-C-O 120.378 0.074 . . . . 0.0 111.947 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -139.44 127.7 22.65 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.934 0.397 . . . . 0.0 111.687 -179.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.645 ' N ' HD12 ' A' ' 38' ' ' ILE . 3.3 mp -120.86 136.57 57.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.627 179.573 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 23.1 mt -116.91 146.13 21.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.075 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.3 mt -123.26 128.18 49.62 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.759 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 20.1 m -125.21 -172.45 2.59 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.388 179.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.448 ' HG3' ' CE2' ' A' ' 47' ' ' PHE . 0.0 OUTLIER -162.55 145.28 11.05 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.367 0.603 . . . . 0.0 111.249 -179.878 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -133.57 169.89 12.78 Favored Pre-proline 0 C--N 1.322 -0.624 0 CA-C-N 115.052 -0.976 . . . . 0.0 109.322 179.339 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -61.71 -25.81 79.22 Favored 'Trans proline' 0 N--CA 1.464 -0.253 0 C-N-CA 121.91 1.74 . . . . 0.0 112.088 179.633 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -90.45 -8.39 50.65 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.273 -0.876 . . . . 0.0 113.044 -178.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 152.47 -169.06 31.62 Favored Glycine 0 C--O 1.225 -0.46 0 C-N-CA 120.065 -1.064 . . . . 0.0 112.515 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.448 ' CE2' ' HG3' ' A' ' 42' ' ' LYS . 10.7 m-85 -106.02 153.95 21.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.597 0.713 . . . . 0.0 112.162 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.597 HG22 ' HG2' ' A' ' 65' ' ' LYS . 54.3 t -127.58 141.39 46.5 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 CA-C-N 114.665 -1.152 . . . . 0.0 110.97 -179.322 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.444 ' O ' ' HA ' ' A' ' 63' ' ' SER . . . -133.05 123.2 25.34 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.549 179.642 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -119.56 150.77 39.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.648 0.261 . . . . 0.0 110.854 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.558 ' N ' HD11 ' A' ' 76' ' ' LEU . . . -147.44 139.73 24.51 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.75 0.309 . . . . 0.0 111.151 179.589 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 4.5 m -135.14 133.27 39.01 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.328 -0.397 . . . . 0.0 110.171 179.583 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.573 ' O ' HG13 ' A' ' 59' ' ' VAL . 18.5 mt -134.52 135.6 53.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.039 0.447 . . . . 0.0 111.387 -179.731 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -104.28 119.66 39.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.458 179.137 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 7.2 p -112.51 167.07 9.73 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.975 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_exo -71.37 -7.84 22.13 Favored 'Trans proline' 0 C--N 1.343 0.279 0 C-N-CA 122.899 2.4 . . . . 0.0 112.636 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -120.19 -4.41 10.0 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 111.776 0.287 . . . . 0.0 111.776 -179.589 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 160.61 -169.76 36.41 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.44 -0.886 . . . . 0.0 112.74 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.573 HG13 ' O ' ' A' ' 53' ' ' ILE . 15.9 t -130.07 143.3 41.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.781 0.324 . . . . 0.0 111.119 -179.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.4 mt -118.35 151.37 37.86 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.044 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.4 ' O ' ' NE2' ' A' ' 83' ' ' GLN . 21.4 t -140.57 143.55 28.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.887 179.882 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.445 ' O ' HD12 ' A' ' 76' ' ' LEU . . . -150.95 151.7 32.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.037 0.446 . . . . 0.0 111.603 -179.767 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . 0.444 ' HA ' ' O ' ' A' ' 49' ' ' ALA . 2.0 t -145.09 155.74 43.51 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.722 -179.423 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.786 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -149.73 102.07 0.23 Allowed Glycine 0 C--N 1.331 0.279 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.609 179.413 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.597 ' HG2' HG22 ' A' ' 48' ' ' VAL . 5.5 mtmp? -103.84 44.55 1.01 Allowed 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -178.804 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.561 ' ND1' HG21 ' A' ' 71' ' ' THR . 12.2 t-80 -75.55 155.64 35.83 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 110.131 -0.322 . . . . 0.0 110.131 178.426 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -60.95 -26.73 67.74 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.731 0.3 . . . . 0.0 111.425 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -97.29 122.17 40.02 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.024 0.44 . . . . 0.0 111.426 -179.314 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 2.5 ttt -47.98 -51.01 25.47 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.891 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 15.9 m-85 -65.89 -37.6 86.55 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.567 -179.122 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.561 HG21 ' ND1' ' A' ' 66' ' ' HIS . 87.5 m -64.7 -41.16 96.21 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.791 0.329 . . . . 0.0 110.649 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.786 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -61.48 -48.2 82.21 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.439 179.607 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.418 ' CG2' HG22 ' A' ' 19' ' ' VAL . 15.7 mt -60.3 -45.47 96.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.869 0.366 . . . . 0.0 110.387 179.635 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -64.29 -39.6 94.25 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.5 179.449 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -65.28 -45.07 85.97 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.449 179.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.558 HD11 ' N ' ' A' ' 51' ' ' ALA . 0.3 OUTLIER -52.57 -58.2 7.53 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 179.129 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.955 HD11 HG13 ' A' ' 19' ' ' VAL . 34.7 mt -57.2 -32.45 40.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 178.82 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -59.0 -28.61 66.54 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-O 121.148 0.499 . . . . 0.0 110.174 178.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.17 -26.84 24.92 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.118 179.151 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.735 HD12 ' HA ' ' A' ' 77' ' ' ILE . 64.9 mt -62.86 -50.01 72.62 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 107.931 -1.137 . . . . 0.0 107.931 177.424 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -60.87 -44.67 96.75 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 114.598 -1.183 . . . . 0.0 110.571 177.711 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 1.1 ptt180 -62.85 -37.59 87.46 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.165 -179.557 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.4 ' NE2' ' O ' ' A' ' 61' ' ' VAL . 35.3 mt-30 -74.28 -40.52 62.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.68 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.655 HD12 ' O ' ' A' ' 80' ' ' LEU . 3.3 mt -64.79 -24.25 67.49 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.682 179.657 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 17.8 t-20 -62.47 -27.73 69.33 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.42 179.592 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 8.0 mmtt . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.205 179.985 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.906 0.384 . . . . 0.0 110.841 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -120.78 98.8 6.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.15 -179.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.493 ' CG2' HD11 ' A' ' 40' ' ' LEU . 34.2 mt -102.63 124.16 56.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.643 179.586 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.8 p -134.25 159.58 40.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.987 0.422 . . . . 0.0 111.097 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 21.5 p -163.86 143.8 8.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.668 -179.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.6 mtmp? -102.51 35.89 2.32 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.035 -179.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -141.11 -47.63 0.4 Allowed 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.777 179.718 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 14.3 mtm -126.22 176.44 7.07 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.691 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -99.79 173.96 6.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.828 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 6.0 mm -91.77 110.76 23.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 121.097 0.475 . . . . 0.0 111.075 -179.677 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 13.2 p -97.52 149.5 35.78 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.146 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_exo -55.84 -20.59 29.51 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.423 2.082 . . . . 0.0 111.746 179.06 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -76.15 -43.92 40.67 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.046 0.45 . . . . 0.0 110.339 179.242 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.653 ' O ' HG23 ' A' ' 19' ' ' VAL . 32.2 mt -72.34 -27.85 27.37 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.283 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.58 179.118 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 29.4 ttt-85 -77.45 -43.68 31.6 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.714 -0.676 . . . . 0.0 109.531 178.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 34.3 tt0 -67.64 -40.69 84.58 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.638 179.067 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.529 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 79.5 t60 -60.99 -57.32 13.13 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.711 -0.395 . . . . 0.0 109.964 179.167 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.738 HG13 HD11 ' A' ' 77' ' ' ILE . 26.9 t -60.35 -47.81 90.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 178.675 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.707 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -59.72 -40.12 86.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.208 -0.451 . . . . 0.0 112.087 179.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.529 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 0.9 OUTLIER -59.59 -35.33 74.09 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 120.497 -0.481 . . . . 0.0 109.999 179.918 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.913 ' O ' HD12 ' A' ' 26' ' ' LEU . 0.5 OUTLIER -76.42 -27.21 56.18 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.775 179.557 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.707 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 5.3 mt -66.48 -56.03 12.82 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.046 0.45 . . . . 0.0 110.225 179.509 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.26 -21.62 64.08 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.162 179.555 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 6.0 tmtm? -79.24 -29.3 42.63 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.686 179.61 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.913 HD12 ' O ' ' A' ' 22' ' ' ARG . 0.4 OUTLIER . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.666 -179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo . . . . . 0 N--CA 1.466 -0.136 0 CA-C-O 120.686 0.203 . . . . 0.0 111.844 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -138.61 126.52 22.42 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.945 0.402 . . . . 0.0 111.521 -179.647 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.64 ' N ' HD12 ' A' ' 38' ' ' ILE . 3.4 mp -118.88 135.71 58.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.626 179.521 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 5.3 mt -116.73 147.08 20.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.227 -179.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.493 HD11 ' CG2' ' A' ' 4' ' ' ILE . 3.3 mt -121.9 127.23 50.21 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.696 179.785 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -124.1 -172.42 2.54 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.482 179.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.426 ' HG3' ' CD2' ' A' ' 47' ' ' PHE . 1.5 ttpt -161.52 139.52 9.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.299 0.571 . . . . 0.0 111.274 -179.686 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -130.81 157.54 77.55 Favored Pre-proline 0 C--N 1.323 -0.553 0 CA-C-N 115.189 -0.914 . . . . 0.0 109.306 179.159 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 70.9 Cg_exo -51.48 -24.63 17.1 Favored 'Trans proline' 0 N--CA 1.464 -0.215 0 C-N-CA 122.012 1.808 . . . . 0.0 112.464 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.5 tt0 -89.2 -6.08 57.18 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.479 -0.782 . . . . 0.0 112.659 -179.14 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 148.86 -160.91 28.56 Favored Glycine 0 C--O 1.224 -0.511 0 C-N-CA 120.289 -0.957 . . . . 0.0 112.224 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.456 ' CD1' ' N ' ' A' ' 47' ' ' PHE . 13.6 m-85 -110.17 154.74 22.91 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.574 0.702 . . . . 0.0 112.096 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.698 HG22 ' HG3' ' A' ' 65' ' ' LYS . 93.7 t -127.22 140.0 50.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 114.691 -1.141 . . . . 0.0 111.036 -179.012 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -131.49 122.19 25.76 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.41 179.402 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -120.3 149.32 42.49 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.691 0.281 . . . . 0.0 111.071 -179.639 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.579 ' N ' HD11 ' A' ' 76' ' ' LEU . . . -146.55 140.04 25.84 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.815 0.341 . . . . 0.0 111.32 179.535 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.0 m -134.33 131.86 38.83 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.031 179.484 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 21.9 mt -132.25 136.22 56.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 121.043 0.449 . . . . 0.0 111.676 -179.427 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 8.3 m120 -100.97 120.74 40.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.596 179.142 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.497 ' HB ' ' HD2' ' A' ' 56' ' ' PRO . 5.5 p -113.46 173.4 2.89 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.244 179.862 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.497 ' HD2' ' HB ' ' A' ' 55' ' ' THR . 86.5 Cg_endo -86.98 1.67 7.29 Favored 'Trans proline' 0 N--CA 1.457 -0.642 0 C-N-CA 122.353 2.036 . . . . 0.0 112.632 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 5.0 m120 -131.58 20.95 4.68 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.315 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 139.99 -167.57 25.35 Favored Glycine 0 C--N 1.331 0.265 0 C-N-CA 120.603 -0.808 . . . . 0.0 112.646 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 19.0 t -128.68 144.12 39.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.757 0.313 . . . . 0.0 111.178 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 16.7 mt -118.33 144.4 45.89 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.026 -179.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 21.6 t -140.26 144.69 27.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.147 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.436 ' O ' HD12 ' A' ' 76' ' ' LEU . . . -153.37 149.77 28.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.063 0.459 . . . . 0.0 111.419 -179.805 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . 0.417 ' HA ' HD12 ' A' ' 76' ' ' LEU . 56.0 p -145.08 159.93 42.19 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.866 -179.239 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.608 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -150.96 107.33 0.34 Allowed Glycine 0 C--N 1.333 0.371 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.713 179.408 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.698 ' HG3' HG22 ' A' ' 48' ' ' VAL . 0.7 OUTLIER -105.25 43.99 1.07 Allowed 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.062 0.393 . . . . 0.0 112.062 -178.813 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.445 ' CE1' HG21 ' A' ' 71' ' ' THR . 13.0 t-80 -77.45 155.51 31.71 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.713 0.292 . . . . 0.0 110.561 179.2 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -61.08 -26.91 67.98 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.337 179.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -98.68 118.99 36.65 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.983 0.42 . . . . 0.0 111.401 -179.313 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.8 tmt? -48.01 -45.77 32.21 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.547 179.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 34.4 m-85 -66.52 -41.05 89.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.222 -179.483 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.445 HG21 ' CE1' ' A' ' 66' ' ' HIS . 90.7 m -65.26 -38.28 89.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.877 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.608 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -62.25 -50.82 70.22 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.87 179.762 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.455 HD11 HD22 ' A' ' 40' ' ' LEU . 8.6 mt -62.01 -42.65 95.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.713 0.292 . . . . 0.0 110.275 179.511 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -63.91 -41.89 97.55 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.957 0.408 . . . . 0.0 110.1 179.206 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -65.93 -41.4 91.41 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.506 179.494 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.579 HD11 ' N ' ' A' ' 51' ' ' ALA . 0.3 OUTLIER -53.45 -62.92 1.34 Allowed 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 179.218 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.738 HD11 HG13 ' A' ' 19' ' ' VAL . 42.8 mt -54.74 -27.21 18.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 110.227 -0.286 . . . . 0.0 110.227 178.831 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -58.99 -39.98 83.46 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 178.0 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.424 ' HB2' ' HB1' ' A' ' 62' ' ' ALA . 0.0 OUTLIER -72.1 -30.62 65.27 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 114.844 -1.071 . . . . 0.0 109.944 178.613 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.846 ' O ' HD12 ' A' ' 84' ' ' LEU . 94.5 mt -63.66 -46.63 84.75 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 107.899 -1.148 . . . . 0.0 107.899 177.575 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 8.2 tt0 -59.98 -51.97 67.41 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 114.894 -1.048 . . . . 0.0 110.628 177.791 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.93 -25.43 68.14 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.384 -179.655 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -74.71 -47.6 30.52 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.837 0.351 . . . . 0.0 110.774 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.846 HD12 ' O ' ' A' ' 80' ' ' LEU . 1.1 mt -64.59 -25.37 67.94 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.809 179.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 -63.47 -33.29 75.25 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.923 0.392 . . . . 0.0 110.386 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.342 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.491 179.786 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . 0.722 ' SD ' HD11 ' A' ' 23' ' ' LEU . 2.9 ttp . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.892 0.377 . . . . 0.0 110.89 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 43.9 t-20 -127.85 98.87 5.31 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.3 -179.819 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.913 HG22 ' HB ' ' A' ' 38' ' ' ILE . 18.3 pt -105.09 130.0 56.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.459 179.331 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 3.1 p -132.9 169.93 16.06 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.879 0.371 . . . . 0.0 111.052 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.443 ' HB3' ' HB2' ' A' ' 40' ' ' LEU . 25.0 p -162.84 136.71 6.14 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.314 -179.441 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -101.15 37.26 1.8 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.952 -179.781 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -140.82 -48.98 0.43 Allowed 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.592 179.625 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -123.11 174.27 7.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.55 179.78 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.5 pm0 -93.95 165.17 12.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.518 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.5 mm -90.98 114.33 28.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 121.012 0.434 . . . . 0.0 110.983 -179.514 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 11.2 p -99.57 150.0 36.39 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.004 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -56.98 -19.24 31.47 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.318 2.012 . . . . 0.0 111.755 178.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -76.8 -42.77 39.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.092 0.473 . . . . 0.0 110.257 179.27 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.562 ' O ' HG23 ' A' ' 19' ' ' VAL . 31.9 mt -72.62 -28.59 28.16 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 CA-C-N 115.575 -0.739 . . . . 0.0 109.446 178.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.41 ' O ' ' CB ' ' A' ' 20' ' ' ALA . 53.2 mtp180 -74.82 -45.84 40.7 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.609 178.696 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -67.35 -38.52 84.95 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.616 179.158 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.448 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 77.8 t60 -60.25 -61.74 2.38 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 179.075 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.796 HG13 HD11 ' A' ' 77' ' ' ILE . 18.9 t -60.56 -47.18 93.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 116.618 -0.264 . . . . 0.0 110.676 178.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.689 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -58.14 -44.91 88.1 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.354 0.501 . . . . 0.0 112.354 -179.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.448 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 0.9 OUTLIER -59.83 -32.84 71.03 Favored 'General case' 0 C--N 1.333 -0.146 0 C-N-CA 120.364 -0.534 . . . . 0.0 110.219 -179.542 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.547 ' O ' HD12 ' A' ' 26' ' ' LEU . 0.0 OUTLIER -73.1 -28.44 62.28 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.652 179.181 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.722 HD11 ' SD ' ' A' ' 2' ' ' MET . 5.1 mt -68.44 -53.86 20.8 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.954 0.406 . . . . 0.0 110.599 179.536 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.34 -23.81 62.82 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.233 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -79.22 -33.36 43.77 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 121.206 0.527 . . . . 0.0 110.113 179.346 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.547 HD12 ' O ' ' A' ' 22' ' ' ARG . 6.1 mt . . . . . 0 C--N 1.327 -0.371 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.047 -179.718 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.551 ' HB3' HG23 ' A' ' 53' ' ' ILE . 92.9 Cg_endo . . . . . 0 N--CA 1.462 -0.354 0 CA-C-O 120.703 0.21 . . . . 0.0 112.0 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -138.34 127.95 24.94 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.976 0.417 . . . . 0.0 111.411 -179.617 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.913 ' HB ' HG22 ' A' ' 4' ' ' ILE . 4.9 mp -120.32 137.2 54.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.929 179.708 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 28.1 mt -119.54 142.21 35.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.172 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.89 HD21 ' CG1' ' A' ' 73' ' ' ILE . 10.0 mt -120.36 130.15 54.27 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.97 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 14.9 m -125.22 -170.65 2.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.528 179.786 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.427 ' HG3' ' CD2' ' A' ' 47' ' ' PHE . 3.5 ttpt -158.67 141.41 14.44 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.431 0.634 . . . . 0.0 111.359 -179.7 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -131.32 156.86 79.56 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 115.113 -0.949 . . . . 0.0 109.217 179.143 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_exo -51.82 -24.46 18.54 Favored 'Trans proline' 0 C--O 1.232 0.198 0 C-N-CA 121.942 1.761 . . . . 0.0 112.375 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 34.5 tt0 -89.44 -6.71 56.28 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.501 -0.772 . . . . 0.0 112.778 -179.146 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 149.22 -162.56 29.02 Favored Glycine 0 C--O 1.225 -0.422 0 C-N-CA 120.269 -0.967 . . . . 0.0 112.205 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.427 ' CD2' ' HG3' ' A' ' 42' ' ' LYS . 18.5 m-85 -109.06 152.65 24.74 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.548 0.689 . . . . 0.0 112.026 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.648 HG22 ' CG ' ' A' ' 65' ' ' LYS . 63.8 t -126.51 141.01 47.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 114.829 -1.078 . . . . 0.0 110.912 -179.324 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -132.13 123.78 27.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.753 179.645 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.403 ' O ' HG23 ' A' ' 38' ' ' ILE . 2.7 m-20 -119.52 149.84 41.24 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.603 0.24 . . . . 0.0 110.855 -179.81 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.53 ' N ' HD11 ' A' ' 76' ' ' LEU . . . -147.3 139.89 24.78 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.72 0.295 . . . . 0.0 111.419 179.615 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.0 m -135.78 129.88 33.19 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.924 -0.399 . . . . 0.0 109.924 179.226 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.566 ' O ' HG13 ' A' ' 59' ' ' VAL . 8.3 mt -133.03 140.42 47.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-O 121.177 0.513 . . . . 0.0 111.96 -179.326 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 8.6 m120 -100.89 118.72 37.49 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.496 -0.774 . . . . 0.0 110.775 179.212 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.4 ' HA ' ' HD3' ' A' ' 56' ' ' PRO . 5.9 p -111.05 146.27 34.16 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.153 179.327 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 55' ' ' THR . 32.3 Cg_exo -58.01 -17.52 31.51 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.27 1.98 . . . . 0.0 112.573 -179.451 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -118.67 23.68 11.33 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.581 -0.282 . . . . 0.0 111.572 -179.714 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 143.99 -165.2 27.38 Favored Glycine 0 C--N 1.331 0.263 0 C-N-CA 120.427 -0.892 . . . . 0.0 113.073 179.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.566 HG13 ' O ' ' A' ' 53' ' ' ILE . 18.4 t -139.84 142.77 31.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.802 0.334 . . . . 0.0 111.015 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.9 mt -118.64 146.39 44.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.947 0.403 . . . . 0.0 111.299 -179.659 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 21.6 t -139.37 145.3 27.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.807 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -154.03 151.64 29.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.2 0.524 . . . . 0.0 111.648 -179.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . 0.441 ' HA ' HD12 ' A' ' 76' ' ' LEU . 0.8 OUTLIER -143.13 156.71 44.85 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.416 -0.811 . . . . 0.0 111.575 -179.393 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.599 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -151.43 105.86 0.29 Allowed Glycine 0 C--N 1.331 0.305 0 N-CA-C 111.487 -0.645 . . . . 0.0 111.487 179.443 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.648 ' CG ' HG22 ' A' ' 48' ' ' VAL . 0.1 OUTLIER -107.92 45.06 1.03 Allowed 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 -178.806 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 15.2 t-80 -75.74 156.15 34.89 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.732 0.301 . . . . 0.0 110.353 178.552 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -60.61 -27.48 67.78 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.323 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -97.89 120.73 38.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.031 0.443 . . . . 0.0 111.461 -179.307 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -48.15 -48.21 34.41 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.724 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 8.2 m-85 -66.4 -41.16 89.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.332 -179.338 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 60.1 m -64.99 -39.49 93.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.798 0.333 . . . . 0.0 110.699 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.599 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -61.72 -50.42 72.49 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.672 179.642 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.89 ' CG1' HD21 ' A' ' 40' ' ' LEU . 8.5 mt -60.87 -43.56 95.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.88 0.372 . . . . 0.0 110.324 179.515 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -63.93 -38.87 92.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.091 179.272 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -66.17 -44.77 83.08 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.409 179.343 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.53 HD11 ' N ' ' A' ' 51' ' ' ALA . 0.3 OUTLIER -51.4 -58.97 4.8 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 179.038 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.796 HD11 HG13 ' A' ' 19' ' ' VAL . 43.5 mt -57.36 -29.32 32.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 109.916 -0.402 . . . . 0.0 109.916 178.6 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -58.84 -30.54 67.75 Favored 'General case' 0 N--CA 1.442 -0.859 0 CA-C-O 121.192 0.52 . . . . 0.0 109.932 178.079 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.5 mptt -84.0 -27.93 28.07 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.387 -0.824 . . . . 0.0 109.834 178.612 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.717 ' O ' HD12 ' A' ' 84' ' ' LEU . 89.8 mt -63.74 -49.55 72.6 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 177.493 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -60.26 -50.18 74.67 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 114.862 -1.063 . . . . 0.0 110.501 177.616 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.88 -25.14 68.15 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.098 -179.741 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 8.4 mt-30 -75.33 -45.68 37.97 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.926 0.393 . . . . 0.0 110.42 179.759 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.717 HD12 ' O ' ' A' ' 80' ' ' LEU . 1.1 mt -65.81 -30.98 71.69 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.83 179.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 47.1 t30 -61.82 -27.75 68.99 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.698 -179.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 2.9 mmtt . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.142 -179.928 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . 0.47 ' HE1' ' HA ' ' A' ' 16' ' ' ARG . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.814 0.34 . . . . 0.0 110.95 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -124.87 130.56 52.61 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.196 -179.795 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.432 HD11 ' SD ' ' A' ' 2' ' ' MET . 38.7 mt -132.7 126.84 55.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.833 179.867 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -133.63 162.2 32.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.988 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.424 ' HB3' ' HB2' ' A' ' 40' ' ' LEU . 21.5 p -164.08 136.92 5.1 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.631 -179.581 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.94 39.26 1.49 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.797 -179.891 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -140.6 -47.81 0.42 Allowed 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.687 179.824 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -133.64 -178.36 4.97 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.898 179.792 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -93.23 164.03 13.39 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.671 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 3.7 mm -90.31 121.05 40.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.886 0.374 . . . . 0.0 110.695 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 17.7 p -101.81 148.21 34.97 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.086 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -56.77 -19.75 32.35 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.413 2.076 . . . . 0.0 111.773 179.203 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -77.61 -40.66 41.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.223 0.535 . . . . 0.0 110.374 179.618 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 26.4 mt -73.09 -31.27 34.4 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.327 178.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.47 ' HA ' ' HE1' ' A' ' 2' ' ' MET . 6.8 mtt85 -72.64 -46.45 53.99 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.512 178.616 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -67.09 -34.81 78.44 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.332 178.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.431 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 78.7 t60 -59.4 -66.02 0.58 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.039 0.447 . . . . 0.0 109.968 178.909 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.683 HG12 HD21 ' A' ' 23' ' ' LEU . 15.7 t -61.41 -46.04 97.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.887 179.166 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.639 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -55.56 -48.25 75.07 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 111.601 0.222 . . . . 0.0 111.601 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.431 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 2.7 p30 -59.51 -28.82 67.39 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.885 0.374 . . . . 0.0 110.538 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.616 ' O ' HD12 ' A' ' 26' ' ' LEU . 18.2 mmt180 -74.75 -29.2 61.07 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.517 179.451 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.683 HD21 HG12 ' A' ' 19' ' ' VAL . 1.1 mt -69.44 -49.65 53.06 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.594 179.185 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.87 -24.96 62.85 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.915 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.45 -37.41 43.65 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.569 179.315 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.616 HD12 ' O ' ' A' ' 22' ' ' ARG . 2.6 mt . . . . . 0 C--N 1.328 -0.334 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.81 179.625 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_endo . . . . . 0 N--CA 1.466 -0.126 0 N-CA-C 111.745 -0.137 . . . . 0.0 111.745 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . 0.443 ' O ' HD13 ' A' ' 38' ' ' ILE . 2.0 t-160 -134.01 132.63 40.33 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.03 0.443 . . . . 0.0 111.521 -179.711 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.443 HD13 ' O ' ' A' ' 37' ' ' HIS . 24.5 mm -123.19 133.7 68.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.773 179.726 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 37.0 mt -120.63 142.21 37.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.875 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.564 HD21 ' CG1' ' A' ' 73' ' ' ILE . 6.1 mt -121.48 127.41 51.04 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.988 0.423 . . . . 0.0 110.813 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -124.47 -171.35 2.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.602 179.813 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.482 ' HA ' ' HA ' ' A' ' 47' ' ' PHE . 0.0 OUTLIER -172.73 146.33 1.62 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.191 0.52 . . . . 0.0 111.018 -179.758 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.438 ' HB3' ' HD2' ' A' ' 44' ' ' PRO . 30.2 mm-40 -131.9 166.89 25.0 Favored Pre-proline 0 C--N 1.324 -0.527 0 CA-C-N 115.415 -0.811 . . . . 0.0 109.11 179.137 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . 0.438 ' HD2' ' HB3' ' A' ' 43' ' ' GLU . 71.4 Cg_exo -49.35 -20.35 3.69 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 121.764 1.643 . . . . 0.0 112.443 -179.327 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 28.9 tt0 -85.44 -76.89 0.31 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.122 179.156 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . 0.445 ' HA3' ' HA ' ' A' ' 67' ' ' GLU . . . -142.44 -156.79 6.91 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.688 -0.767 . . . . 0.0 112.645 -179.339 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.482 ' HA ' ' HA ' ' A' ' 42' ' ' LYS . 21.4 m-85 -108.17 151.05 26.44 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.607 0.718 . . . . 0.0 112.58 -179.315 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.525 HG22 ' HG2' ' A' ' 65' ' ' LYS . 63.5 t -124.61 142.61 40.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 114.543 -1.208 . . . . 0.0 110.537 -179.775 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.439 ' O ' ' HA ' ' A' ' 63' ' ' SER . . . -133.09 125.17 29.0 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.026 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -118.39 145.69 44.98 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.356 179.765 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.753 ' CB ' HD11 ' A' ' 76' ' ' LEU . . . -144.69 142.2 29.89 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.798 -0.361 . . . . 0.0 111.602 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.604 ' O ' HD13 ' A' ' 53' ' ' ILE . 9.2 m -136.14 135.6 39.38 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.582 179.735 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.647 ' O ' HG13 ' A' ' 59' ' ' VAL . 4.0 mm -132.51 133.63 59.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.709 0.29 . . . . 0.0 110.915 -179.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -108.98 121.81 45.92 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.529 179.386 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 28.4 p -121.67 164.99 21.49 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.1 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 20.0 Cg_exo -65.9 -11.73 32.18 Favored 'Trans proline' 0 C--N 1.343 0.288 0 C-N-CA 122.785 2.323 . . . . 0.0 112.763 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -111.06 -3.39 15.51 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 111.819 0.303 . . . . 0.0 111.819 -179.601 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 152.39 -167.2 31.34 Favored Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.467 -0.873 . . . . 0.0 112.765 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.647 HG13 ' O ' ' A' ' 53' ' ' ILE . 17.2 t -131.95 140.65 47.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.73 0.3 . . . . 0.0 111.144 -179.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.7 mt -117.54 153.81 32.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.889 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 13.8 p -140.42 149.62 21.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.307 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.502 ' O ' HD12 ' A' ' 76' ' ' LEU . . . -153.99 154.73 34.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.098 0.475 . . . . 0.0 111.411 -179.824 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . 0.439 ' HA ' ' O ' ' A' ' 49' ' ' ALA . 0.1 OUTLIER -144.79 157.31 44.22 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.753 -179.315 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.762 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -151.87 105.16 0.28 Allowed Glycine 0 C--N 1.331 0.304 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.61 179.4 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.525 ' HG2' HG22 ' A' ' 48' ' ' VAL . 8.7 mtpt -107.62 44.73 1.06 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -178.65 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.651 ' ND1' HG21 ' A' ' 71' ' ' THR . 13.9 t-80 -76.18 156.29 33.8 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.877 0.37 . . . . 0.0 110.421 178.522 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.445 ' HA ' ' HA3' ' A' ' 46' ' ' GLY . 1.2 tt0 -60.88 -26.9 67.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.786 0.327 . . . . 0.0 111.119 179.844 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -97.59 123.93 41.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.028 0.442 . . . . 0.0 111.458 -179.292 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 17.1 ttt -48.2 -50.27 29.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.834 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . 0.404 ' HA ' HD12 ' A' ' 73' ' ' ILE . 46.4 m-85 -66.24 -36.74 83.79 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.635 -179.118 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.651 HG21 ' ND1' ' A' ' 66' ' ' HIS . 98.7 m -64.34 -42.28 96.35 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.721 0.296 . . . . 0.0 110.529 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.762 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -61.2 -47.52 85.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.37 179.442 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.604 ' CG2' HG22 ' A' ' 19' ' ' VAL . 14.7 mt -60.35 -47.11 93.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.548 179.645 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -63.96 -39.14 93.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.596 179.65 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -65.49 -44.97 85.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.469 179.576 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.753 HD11 ' CB ' ' A' ' 51' ' ' ALA . 0.2 OUTLIER -53.01 -57.84 9.0 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 179.194 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.603 HD11 HG13 ' A' ' 19' ' ' VAL . 9.3 mt -57.01 -31.97 38.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 178.824 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -59.11 -30.06 67.83 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-O 121.139 0.495 . . . . 0.0 110.324 178.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.483 ' HB2' ' HB1' ' A' ' 62' ' ' ALA . 3.8 mptt -84.65 -25.71 28.31 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.217 179.092 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.439 HD12 ' HA ' ' A' ' 77' ' ' ILE . 90.5 mt -62.21 -48.87 78.08 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 107.599 -1.26 . . . . 0.0 107.599 177.111 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.709 ' HA ' HD12 ' A' ' 84' ' ' LEU . 4.2 tt0 -60.22 -44.63 95.03 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 114.362 -1.29 . . . . 0.0 110.549 177.585 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 85.3 mtt180 -61.59 -31.38 71.43 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.882 -179.703 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 17.0 mt-30 -75.61 -39.78 57.39 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.936 0.398 . . . . 0.0 110.438 179.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.709 HD12 ' HA ' ' A' ' 81' ' ' GLU . 6.5 mt -66.09 -30.33 70.82 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.826 179.611 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -63.69 -22.64 67.01 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.908 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 5.6 mmtm . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.62 179.974 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . 0.531 ' SD ' HD11 ' A' ' 23' ' ' LEU . 2.5 tpt . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.811 0.339 . . . . 0.0 110.852 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -124.24 116.49 22.76 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.484 -179.651 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 35.2 mt -118.98 125.23 74.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.396 179.389 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -134.35 162.63 31.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.907 0.384 . . . . 0.0 111.313 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.452 ' HB3' ' HB2' ' A' ' 40' ' ' LEU . 21.5 p -162.32 143.25 10.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.35 -179.744 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -102.81 -11.79 18.05 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.626 -179.452 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.03 -25.07 14.43 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 120.757 0.313 . . . . 0.0 111.132 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 1.4 mpp? -137.69 -165.98 1.87 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.871 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 13.6 tt0 -124.02 164.54 19.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.64 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.515 HG22 ' HG3' ' A' ' 16' ' ' ARG . 4.9 mm -91.2 111.32 23.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 121.075 0.464 . . . . 0.0 111.223 -179.497 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 15.1 p -98.22 152.72 38.13 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.034 179.807 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -58.5 -18.82 41.23 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.416 2.077 . . . . 0.0 111.757 179.278 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -79.19 -43.19 24.39 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.976 0.417 . . . . 0.0 110.519 179.27 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.48 ' O ' HG23 ' A' ' 19' ' ' VAL . 30.4 mt -72.26 -28.8 29.95 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.412 178.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.515 ' HG3' HG22 ' A' ' 11' ' ' ILE . 19.5 mtm180 -74.63 -44.98 47.83 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.569 178.797 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 19.0 tt0 -67.69 -39.25 84.44 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.761 179.094 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.534 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 78.2 t60 -60.14 -58.18 9.64 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.623 -0.431 . . . . 0.0 109.881 179.018 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.859 HG13 HD11 ' A' ' 77' ' ' ILE . 44.3 t -60.86 -47.54 92.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-O 120.714 0.293 . . . . 0.0 110.258 178.453 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.693 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -58.25 -42.74 87.07 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.204 0.446 . . . . 0.0 112.204 179.77 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.534 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 0.9 OUTLIER -59.2 -35.83 74.3 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 121.007 0.432 . . . . 0.0 110.243 -179.898 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.559 ' O ' HD12 ' A' ' 26' ' ' LEU . 5.2 mmm180 -76.09 -25.98 56.0 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.581 179.458 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.693 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 3.3 mt -68.31 -56.93 6.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.136 0.493 . . . . 0.0 110.393 179.542 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.08 -25.04 66.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.675 -179.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 7.8 tmtm? -79.11 -41.03 29.58 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.057 0.456 . . . . 0.0 110.506 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.559 HD12 ' O ' ' A' ' 22' ' ' ARG . 7.0 mt . . . . . 0 C--N 1.327 -0.383 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.688 179.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo . . . . . 0 N--CA 1.463 -0.277 0 CA-C-O 120.773 0.239 . . . . 0.0 112.022 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 2.0 t-160 -136.64 127.21 26.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.121 -179.7 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.634 ' N ' HD12 ' A' ' 38' ' ' ILE . 3.3 mp -119.58 135.24 60.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.92 179.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.53 ' C ' HD22 ' A' ' 40' ' ' LEU . 5.5 mt -116.54 142.94 27.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.808 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.53 HD22 ' C ' ' A' ' 39' ' ' ILE . 3.7 mm? -116.29 127.47 54.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.068 -179.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -123.5 -174.71 3.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.303 179.586 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.433 ' HG3' ' CD2' ' A' ' 47' ' ' PHE . 2.2 ttpp -159.99 139.35 11.05 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.282 0.563 . . . . 0.0 111.303 -179.731 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -130.9 156.07 80.56 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-N 115.091 -0.958 . . . . 0.0 109.241 179.161 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_exo -51.34 -24.39 15.77 Favored 'Trans proline' 0 N--CA 1.465 -0.186 0 C-N-CA 121.936 1.757 . . . . 0.0 112.464 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.31 -6.56 56.61 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.439 -0.8 . . . . 0.0 112.654 -179.177 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 149.82 -162.42 29.13 Favored Glycine 0 C--O 1.224 -0.483 0 C-N-CA 120.248 -0.977 . . . . 0.0 112.222 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.433 ' CD2' ' HG3' ' A' ' 42' ' ' LYS . 17.9 m-85 -110.01 154.55 23.02 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.425 0.631 . . . . 0.0 111.986 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.668 HG22 ' CB ' ' A' ' 65' ' ' LYS . 55.4 t -129.19 139.04 52.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 114.966 -1.015 . . . . 0.0 111.064 -179.297 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.403 ' O ' ' HA ' ' A' ' 63' ' ' SER . . . -129.82 123.34 30.67 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.265 179.47 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -119.08 149.67 41.29 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.718 0.294 . . . . 0.0 111.051 -179.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.473 ' N ' HD11 ' A' ' 76' ' ' LEU . . . -145.85 140.16 26.86 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.437 179.746 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.1 m -134.86 130.72 36.43 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.018 179.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.534 ' O ' HG13 ' A' ' 59' ' ' VAL . 6.7 mt -132.69 137.3 54.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 121.047 0.451 . . . . 0.0 111.68 -179.478 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -102.28 134.96 44.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.796 179.283 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 6.0 p -129.88 160.55 64.46 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.418 179.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_exo -67.59 -10.51 28.97 Favored 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.461 2.108 . . . . 0.0 112.687 -179.68 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -115.79 -3.94 12.18 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 111.801 0.297 . . . . 0.0 111.801 -179.697 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 159.25 -167.12 34.91 Favored Glycine 0 C--N 1.331 0.282 0 C-N-CA 120.391 -0.909 . . . . 0.0 112.82 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.534 HG13 ' O ' ' A' ' 53' ' ' ILE . 15.4 t -131.64 140.89 47.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 120.802 0.334 . . . . 0.0 111.163 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.712 HD23 ' HB3' ' A' ' 83' ' ' GLN . 6.5 mp -116.47 151.6 35.75 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.045 -179.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 14.1 p -139.96 149.05 22.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.147 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -154.93 150.2 27.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.302 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . 0.527 ' HA ' HD12 ' A' ' 76' ' ' LEU . 0.9 OUTLIER -145.8 156.49 43.62 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.783 -179.402 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.781 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -150.04 104.6 0.28 Allowed Glycine 0 CA--C 1.519 0.335 0 N-CA-C 111.37 -0.692 . . . . 0.0 111.37 179.287 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.668 ' CB ' HG22 ' A' ' 48' ' ' VAL . 6.0 mtmt -106.93 45.11 1.0 Allowed 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -178.625 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.57 ' ND1' HG21 ' A' ' 71' ' ' THR . 12.3 t-80 -75.72 156.91 34.23 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 178.572 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.4 pm0 -60.17 -27.24 66.95 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.759 0.314 . . . . 0.0 111.263 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -98.63 118.43 35.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.975 0.417 . . . . 0.0 111.301 -179.553 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 11.5 ttt -47.43 -45.04 25.3 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.559 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 8.5 m-85 -66.7 -39.67 88.17 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.072 -179.716 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.57 HG21 ' ND1' ' A' ' 66' ' ' HIS . 93.2 m -65.41 -38.79 91.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.73 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.781 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -61.62 -50.8 71.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.758 179.644 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.61 HG21 HG22 ' A' ' 19' ' ' VAL . 6.8 mt -62.08 -41.18 90.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-O 120.741 0.305 . . . . 0.0 110.243 179.355 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -64.06 -41.72 97.26 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.923 0.392 . . . . 0.0 110.047 179.096 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 62.0 mt-10 -67.26 -41.08 86.17 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.829 179.502 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.527 HD12 ' HA ' ' A' ' 63' ' ' SER . 0.4 OUTLIER -54.64 -64.78 0.72 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.326 179.662 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.859 HD11 HG13 ' A' ' 19' ' ' VAL . 55.5 mt -55.85 -26.79 21.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.567 -0.288 . . . . 0.0 110.272 178.929 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -58.53 -39.62 80.66 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 178.066 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.16 -30.86 63.88 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.834 -1.076 . . . . 0.0 110.287 178.754 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.818 ' O ' HD12 ' A' ' 84' ' ' LEU . 90.3 mt -61.66 -45.2 95.06 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 107.61 -1.256 . . . . 0.0 107.61 177.451 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.406 ' HG3' HD22 ' A' ' 26' ' ' LEU . 21.9 tt0 -57.33 -52.57 64.83 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 114.807 -1.088 . . . . 0.0 110.287 177.332 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 39.7 mtt180 -65.18 -16.55 63.64 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.566 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.712 ' HB3' HD23 ' A' ' 60' ' ' LEU . 8.2 mt-30 -75.44 -55.3 5.83 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.564 0.221 . . . . 0.0 111.067 -179.826 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.818 HD12 ' O ' ' A' ' 80' ' ' LEU . 2.5 mp -64.12 -27.68 69.25 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.089 0.471 . . . . 0.0 110.456 179.62 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -61.92 -36.27 80.87 Favored 'General case' 0 CA--C 1.521 -0.157 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.352 -179.27 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 8.4 mmtm . . . . . 0 C--N 1.327 -0.389 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.11 -179.757 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . 0.71 ' CG ' HD11 ' A' ' 23' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.79 0.328 . . . . 0.0 110.944 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 39.4 t-20 -113.56 142.17 46.29 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.485 -179.689 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.639 ' CG2' HD11 ' A' ' 40' ' ' LEU . 21.2 mt -131.37 123.84 53.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.597 179.499 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.8 p -134.92 157.5 46.7 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.947 0.403 . . . . 0.0 111.31 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.46 ' HB3' HD12 ' A' ' 40' ' ' LEU . 21.7 p -163.32 143.32 8.82 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.508 -179.733 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.4 mtmt -101.05 12.56 37.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.294 -179.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -142.43 25.87 1.83 Allowed 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.801 179.587 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 2.4 mtm 179.37 172.51 0.89 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.859 -179.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 14.0 pm0 -114.9 168.41 9.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.477 179.583 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.631 HG22 ' HG3' ' A' ' 16' ' ' ARG . 6.5 mm -89.94 107.99 18.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 121.061 0.457 . . . . 0.0 111.349 -179.263 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 14.1 p -97.28 150.98 37.4 Favored Pre-proline 0 C--N 1.327 -0.389 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.831 179.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_endo -56.08 -26.8 61.57 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.475 2.117 . . . . 0.0 111.66 179.069 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -71.43 -44.6 64.54 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.634 179.47 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.681 ' O ' HG23 ' A' ' 19' ' ' VAL . 34.7 mt -72.19 -27.92 27.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 178.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.631 ' HG3' HG22 ' A' ' 11' ' ' ILE . 63.1 mtm180 -76.39 -44.63 35.3 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.776 178.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -67.75 -40.37 84.1 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.686 179.14 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.509 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 78.1 t60 -60.57 -58.0 10.35 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 179.07 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.681 HG23 ' O ' ' A' ' 15' ' ' ILE . 22.0 t -60.01 -47.49 91.59 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.447 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 178.554 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.718 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -59.4 -39.66 84.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.934 179.654 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.509 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 0.9 OUTLIER -59.64 -34.75 73.2 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 121.134 0.492 . . . . 0.0 109.924 179.915 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.738 ' O ' HD12 ' A' ' 26' ' ' LEU . 36.5 mmt180 -75.55 -25.4 57.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.713 179.35 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.718 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 14.8 mt -66.98 -55.82 12.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.104 0.478 . . . . 0.0 110.083 179.199 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.57 -21.92 63.12 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.135 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -78.91 -30.58 44.92 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.119 0.485 . . . . 0.0 110.312 179.375 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.738 HD12 ' O ' ' A' ' 22' ' ' ARG . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.561 179.691 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo . . . . . 0 N--CA 1.461 -0.401 0 N-CA-C 110.966 -0.436 . . . . 0.0 110.966 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 1.4 t-160 -134.49 128.91 34.34 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.104 0.478 . . . . 0.0 112.155 -178.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.45 ' N ' HD12 ' A' ' 38' ' ' ILE . 4.9 mp -119.49 133.52 66.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.152 179.189 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.412 HG22 ' N ' ' A' ' 40' ' ' LEU . 38.4 mt -116.43 154.39 18.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.908 0.385 . . . . 0.0 111.51 -179.51 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.639 HD11 ' CG2' ' A' ' 4' ' ' ILE . 0.8 OUTLIER -127.28 126.01 41.89 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.711 179.773 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 3.2 m -123.18 -176.67 3.48 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.655 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.501 ' HG3' ' CE2' ' A' ' 47' ' ' PHE . 0.1 OUTLIER -158.42 138.1 11.97 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.324 0.583 . . . . 0.0 111.26 -179.63 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -130.74 155.49 81.25 Favored Pre-proline 0 C--N 1.322 -0.614 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.393 179.285 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -51.16 -24.69 15.41 Favored 'Trans proline' 0 C--O 1.232 0.221 0 C-N-CA 122.013 1.809 . . . . 0.0 112.372 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.41 -6.5 56.51 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.582 -0.736 . . . . 0.0 112.612 -179.15 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 150.12 -162.58 29.25 Favored Glycine 0 C--O 1.224 -0.477 0 C-N-CA 120.245 -0.978 . . . . 0.0 112.3 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.501 ' CE2' ' HG3' ' A' ' 42' ' ' LYS . 11.3 m-85 -109.92 155.25 21.98 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.435 0.636 . . . . 0.0 111.927 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.635 HG22 ' CB ' ' A' ' 65' ' ' LYS . 49.1 t -129.2 139.09 52.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 114.945 -1.025 . . . . 0.0 111.205 -179.198 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -130.49 122.94 28.58 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.444 179.44 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -119.64 149.77 41.43 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.828 0.347 . . . . 0.0 111.017 -179.672 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.615 ' N ' HD11 ' A' ' 76' ' ' LEU . . . -145.28 139.39 27.06 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.166 179.567 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.0 m -135.43 130.94 35.58 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.251 179.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.495 ' O ' HG13 ' A' ' 59' ' ' VAL . 16.1 mt -132.72 135.27 57.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 120.912 0.387 . . . . 0.0 111.412 -179.653 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -103.13 134.49 46.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.442 179.365 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.477 ' HB ' ' HD2' ' A' ' 56' ' ' PRO . 58.1 p -133.07 157.44 78.31 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.561 179.809 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.477 ' HD2' ' HB ' ' A' ' 55' ' ' THR . 43.1 Cg_endo -68.31 -7.34 19.82 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.302 2.001 . . . . 0.0 112.716 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 88.5 m-20 -124.14 22.93 8.58 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.591 0.234 . . . . 0.0 111.604 -179.803 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 138.69 -165.51 25.55 Favored Glycine 0 C--N 1.331 0.294 0 C-N-CA 120.406 -0.902 . . . . 0.0 112.964 179.728 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.495 HG13 ' O ' ' A' ' 53' ' ' ILE . 21.4 t -142.4 144.53 24.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.766 0.317 . . . . 0.0 111.122 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.676 HD21 ' HG ' ' A' ' 84' ' ' LEU . 8.4 mp -118.7 142.82 47.31 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.306 -179.667 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 21.4 t -140.81 142.33 30.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.907 179.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.512 ' O ' HD12 ' A' ' 76' ' ' LEU . . . -153.51 154.39 34.24 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.257 0.551 . . . . 0.0 111.609 -179.708 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 80.3 p -145.09 159.55 42.79 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.828 -179.263 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.789 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -152.61 102.8 0.23 Allowed Glycine 0 C--N 1.331 0.305 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.47 179.466 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.635 ' CB ' HG22 ' A' ' 48' ' ' VAL . 0.0 OUTLIER -105.42 44.33 1.05 Allowed 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -178.771 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 12.5 t-80 -75.23 156.28 35.92 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.589 -0.278 . . . . 0.0 110.253 178.57 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -60.2 -27.25 67.01 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.727 0.299 . . . . 0.0 111.364 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 32.5 t0 -97.66 116.53 30.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.931 0.396 . . . . 0.0 111.191 -179.375 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . 0.41 ' O ' HD12 ' A' ' 73' ' ' ILE . 1.4 ttt -46.92 -44.06 19.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.414 179.821 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -66.81 -42.38 85.98 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.886 -179.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 71.5 m -65.75 -37.51 86.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.917 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.789 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -61.96 -52.93 62.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.958 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.443 HG21 HG22 ' A' ' 19' ' ' VAL . 6.3 mt -61.6 -41.32 89.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.827 0.346 . . . . 0.0 110.235 179.505 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -63.7 -40.0 95.72 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.267 -0.424 . . . . 0.0 109.929 179.068 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -66.35 -41.6 89.3 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.478 179.293 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.711 HD23 HG13 ' A' ' 77' ' ' ILE . 0.2 OUTLIER -52.74 -62.32 1.72 Allowed 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 179.042 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.711 HG13 HD23 ' A' ' 76' ' ' LEU . 4.9 mt -55.9 -29.14 25.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 178.507 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -59.26 -30.51 68.34 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-O 121.112 0.482 . . . . 0.0 110.14 178.27 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.447 ' HA ' ' CE ' ' A' ' 79' ' ' LYS . 0.1 OUTLIER -86.9 -28.02 23.05 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.446 179.069 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.773 ' O ' HD12 ' A' ' 84' ' ' LEU . 92.5 mt -63.73 -48.82 75.51 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.048 -1.094 . . . . 0.0 108.048 177.596 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -60.21 -49.87 75.9 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 114.984 -1.007 . . . . 0.0 110.462 177.741 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 3.6 mtt180 -63.92 -25.51 68.18 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.476 -179.535 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 23.7 mt-30 -73.87 -45.93 47.95 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.811 0.339 . . . . 0.0 110.703 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.773 HD12 ' O ' ' A' ' 80' ' ' LEU . 0.9 OUTLIER -64.84 -28.61 69.67 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.799 179.835 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -62.38 -28.64 69.92 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.003 0.43 . . . . 0.0 110.308 179.619 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.331 -0.233 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.394 179.628 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.836 0.351 . . . . 0.0 110.854 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -125.31 134.61 52.18 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.236 -179.708 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.62 HG12 HD12 ' A' ' 11' ' ' ILE . 9.0 tt -135.09 125.94 45.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.349 179.72 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 3.0 p -134.76 165.33 25.53 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.901 0.381 . . . . 0.0 111.446 -179.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.4 ' HB3' ' HB2' ' A' ' 40' ' ' LEU . 3.2 p -161.59 130.42 4.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.978 -0.556 . . . . 0.0 109.991 -179.388 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 15.0 mtmt -99.0 13.67 31.92 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.271 -179.601 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 11.2 tp60 -141.91 21.67 2.12 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.636 179.319 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 176.74 161.96 0.41 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.51 -179.754 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -96.62 160.28 14.47 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.21 179.39 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.62 HD12 HG12 ' A' ' 4' ' ' ILE . 3.9 mm -90.27 119.3 37.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.002 0.429 . . . . 0.0 111.202 -179.372 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.418 ' H ' HD12 ' A' ' 15' ' ' ILE . 16.8 p -100.58 157.27 34.05 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.641 179.434 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_exo -61.01 -15.08 36.74 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.477 2.118 . . . . 0.0 112.233 179.54 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -88.7 -38.72 14.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.904 0.383 . . . . 0.0 110.725 179.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.418 HD12 ' H ' ' A' ' 12' ' ' THR . 18.2 mt -73.57 -31.75 33.62 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 N-CA-C 109.484 -0.562 . . . . 0.0 109.484 179.028 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.412 ' O ' ' CB ' ' A' ' 20' ' ' ALA . 0.4 OUTLIER -72.55 -46.62 53.62 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.273 178.749 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -67.04 -33.64 75.97 Favored 'General case' 0 N--CA 1.456 -0.171 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.189 178.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.413 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 77.6 t60 -58.85 -66.22 0.54 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.995 0.426 . . . . 0.0 109.854 178.659 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.677 HG12 HD21 ' A' ' 23' ' ' LEU . 12.2 t -61.39 -44.61 98.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.796 178.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.602 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -55.15 -50.13 70.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.56 179.703 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.413 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 3.1 p30 -59.02 -28.57 66.54 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-O 120.894 0.378 . . . . 0.0 110.567 -179.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.518 ' CB ' HD13 ' A' ' 77' ' ' ILE . 13.8 mmt180 -74.09 -28.84 61.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.447 179.349 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.677 HD21 HG12 ' A' ' 19' ' ' VAL . 1.1 mt -69.7 -47.35 63.5 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.304 179.086 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.99 -27.35 66.79 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.962 179.617 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -79.34 -31.91 43.17 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.775 179.539 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.59 HD11 ' CG2' ' A' ' 77' ' ' ILE . 10.1 mt . . . . . 0 C--N 1.328 -0.358 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.863 179.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo . . . . . 0 C--O 1.232 0.19 0 N-CA-C 111.854 -0.095 . . . . 0.0 111.854 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . 0.706 ' C ' HD12 ' A' ' 38' ' ' ILE . 19.5 t-160 -134.42 133.73 40.84 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.711 -0.396 . . . . 0.0 111.411 -179.785 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.706 HD12 ' C ' ' A' ' 37' ' ' HIS . 2.7 mp -126.17 131.09 71.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.666 179.619 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 25.1 mt -121.31 138.93 50.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.71 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.4 ' HB2' ' HB3' ' A' ' 6' ' ' SER . 10.0 mt -121.31 127.96 51.84 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.949 0.404 . . . . 0.0 110.811 179.868 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 8.5 m -125.59 -170.57 2.2 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.751 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.459 ' HA ' ' HA ' ' A' ' 47' ' ' PHE . 3.9 tttt -171.85 146.78 2.11 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.113 0.483 . . . . 0.0 110.794 -179.879 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.437 ' N ' ' HG2' ' A' ' 42' ' ' LYS . 7.2 mt-10 -131.45 169.57 13.45 Favored Pre-proline 0 C--N 1.324 -0.536 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.06 178.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . 0.426 ' HD2' ' HB3' ' A' ' 43' ' ' GLU . 69.1 Cg_exo -51.61 -19.96 8.32 Favored 'Trans proline' 0 N--CA 1.463 -0.307 0 C-N-CA 121.776 1.65 . . . . 0.0 112.23 -179.416 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -85.73 -76.71 0.32 Allowed 'General case' 0 N--CA 1.445 -0.708 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.309 179.379 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . 0.452 ' HA3' ' HA ' ' A' ' 67' ' ' GLU . . . -142.99 -156.75 6.88 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.766 -179.336 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.459 ' HA ' ' HA ' ' A' ' 42' ' ' LYS . 22.3 m-85 -108.06 150.61 26.95 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-O 121.65 0.738 . . . . 0.0 112.57 -179.302 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.574 HG13 ' HG2' ' A' ' 65' ' ' LYS . 62.2 t -124.78 140.76 47.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 114.477 -1.238 . . . . 0.0 110.405 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -132.19 124.41 28.96 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.672 -0.24 . . . . 0.0 110.715 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -120.65 147.04 45.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.62 -0.264 . . . . 0.0 110.67 -179.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.676 ' N ' HD11 ' A' ' 76' ' ' LEU . . . -145.39 142.03 28.98 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.899 0.381 . . . . 0.0 111.433 179.738 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.457 HG23 HG22 ' A' ' 61' ' ' VAL . 3.9 m -136.02 131.67 35.28 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.101 -0.5 . . . . 0.0 109.99 179.419 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.513 ' O ' HG13 ' A' ' 59' ' ' VAL . 22.0 mt -132.85 137.52 53.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 121.0 0.429 . . . . 0.0 111.344 -179.637 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -105.02 128.77 53.46 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.184 179.092 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.633 ' HB ' ' HD2' ' A' ' 56' ' ' PRO . 5.7 p -124.82 166.35 20.63 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.361 -179.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.633 ' HD2' ' HB ' ' A' ' 55' ' ' THR . 56.7 Cg_endo -72.79 -4.08 14.72 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.228 1.952 . . . . 0.0 112.529 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 81.1 m-20 -117.98 -4.3 11.08 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.406 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 154.1 -171.93 32.72 Favored Glycine 0 C--N 1.332 0.333 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.699 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.513 HG13 ' O ' ' A' ' 53' ' ' ILE . 21.4 t -127.33 142.69 42.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.739 0.304 . . . . 0.0 111.093 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 30.1 mt -119.37 152.36 36.93 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.323 -0.398 . . . . 0.0 111.315 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.457 HG22 HG23 ' A' ' 52' ' ' THR . 21.6 t -141.56 143.61 27.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.815 179.735 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.491 ' HB2' HE22 ' A' ' 83' ' ' GLN . . . -151.0 156.9 42.11 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.13 0.491 . . . . 0.0 111.545 -179.624 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 10.6 m -145.16 154.78 42.79 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.718 -179.326 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.754 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -148.91 100.78 0.21 Allowed Glycine 0 C--N 1.332 0.357 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.699 179.4 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.574 ' HG2' HG13 ' A' ' 48' ' ' VAL . 8.8 mttt -102.52 44.57 1.0 Allowed 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -178.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.62 ' ND1' HG21 ' A' ' 71' ' ' THR . 12.1 t-80 -76.36 155.3 34.23 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.78 0.324 . . . . 0.0 110.311 178.536 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.452 ' HA ' ' HA3' ' A' ' 46' ' ' GLY . 26.0 mt-10 -62.06 -26.22 68.14 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.759 0.314 . . . . 0.0 111.339 -179.871 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -97.28 121.95 39.76 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.044 0.449 . . . . 0.0 111.358 -179.395 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.6 ttt -47.51 -51.37 20.81 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.998 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 36.3 m-85 -65.91 -36.77 84.3 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.729 -179.023 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.62 HG21 ' ND1' ' A' ' 66' ' ' HIS . 94.2 m -64.23 -42.23 96.65 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.824 0.345 . . . . 0.0 110.658 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.754 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -61.51 -47.22 86.61 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.429 179.606 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.44 HG21 HG22 ' A' ' 19' ' ' VAL . 28.8 mt -59.71 -48.74 86.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.77 179.739 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 19.6 m-20 -64.03 -38.54 91.43 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.74 179.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -65.37 -45.66 83.22 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.606 179.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.676 HD11 ' N ' ' A' ' 51' ' ' ALA . 0.3 OUTLIER -54.22 -56.28 19.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.541 -0.3 . . . . 0.0 110.418 179.425 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.59 ' CG2' HD11 ' A' ' 26' ' ' LEU . 52.3 mt -57.86 -33.21 45.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 N-CA-C 110.227 -0.286 . . . . 0.0 110.227 179.231 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -58.63 -35.52 72.64 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.545 0.688 . . . . 0.0 109.781 178.641 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.4 mptp? -76.81 -27.77 55.31 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 114.83 -1.077 . . . . 0.0 110.138 179.409 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.509 HD12 ' HA ' ' A' ' 77' ' ' ILE . 96.3 mt -62.05 -50.14 73.19 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 177.472 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.462 ' HA ' HD12 ' A' ' 84' ' ' LEU . 2.5 tt0 -62.79 -46.25 88.86 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 114.277 -1.329 . . . . 0.0 110.709 177.869 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.69 -34.14 75.23 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.07 -179.588 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.491 HE22 ' HB2' ' A' ' 62' ' ' ALA . 36.9 mt-30 -75.39 -36.08 60.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.586 179.713 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.462 HD12 ' HA ' ' A' ' 81' ' ' GLU . 4.3 mt -64.66 -27.68 69.09 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.83 179.869 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -64.17 -26.02 68.34 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.729 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.307 0 CA-C-O 121.215 0.531 . . . . 0.0 110.85 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . 0.688 ' HG3' HD11 ' A' ' 23' ' ' LEU . 5.9 tmm? . . . . . 0 C--O 1.231 0.084 0 CA-C-O 120.778 0.323 . . . . 0.0 110.827 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -124.0 107.15 11.0 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.369 -179.704 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 40.0 mt -109.09 126.14 66.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.619 179.546 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -133.99 162.01 33.23 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.922 0.391 . . . . 0.0 111.147 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.422 ' HB3' ' HB2' ' A' ' 40' ' ' LEU . 21.6 p -162.72 137.58 6.69 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.298 -179.586 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.4 mmtt -101.82 34.65 2.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.116 -179.569 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -141.96 -45.3 0.34 Allowed 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.942 179.711 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.41 -177.81 4.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.84 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -106.8 163.95 12.51 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.435 179.817 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 3.8 mm -90.32 118.07 34.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 121.037 0.446 . . . . 0.0 111.009 -179.557 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.401 ' HB ' ' HD2' ' A' ' 13' ' ' PRO . 16.1 p -100.84 153.99 37.42 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.854 179.648 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.401 ' HD2' ' HB ' ' A' ' 12' ' ' THR . 15.2 Cg_endo -57.37 -27.33 75.15 Favored 'Trans proline' 0 C--N 1.343 0.289 0 C-N-CA 122.417 2.078 . . . . 0.0 111.904 179.306 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -74.82 -40.41 61.08 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.934 0.397 . . . . 0.0 110.518 179.665 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 26.0 mt -73.14 -31.05 33.28 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 178.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.92 -46.24 58.36 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.399 178.73 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -67.61 -35.15 78.4 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.306 178.89 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.44 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 52.6 t60 -58.29 -63.56 1.22 Allowed 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 178.671 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.641 HG12 HD21 ' A' ' 23' ' ' LEU . 28.6 t -61.41 -42.9 95.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.528 -0.305 . . . . 0.0 110.258 178.58 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.646 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -56.62 -46.13 81.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.46 179.401 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.44 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 1.2 p30 -60.02 -31.88 70.36 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 120.923 0.392 . . . . 0.0 110.546 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 36.1 mmt180 -73.23 -27.11 61.41 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.613 179.66 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.688 HD11 ' HG3' ' A' ' 2' ' ' MET . 2.0 mt -68.78 -49.82 55.47 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.118 0.485 . . . . 0.0 109.994 178.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.21 -26.42 66.36 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.016 179.459 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 19.8 tttt -77.22 -32.74 56.1 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.726 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.749 HD11 ' CG2' ' A' ' 77' ' ' ILE . 5.1 mt . . . . . 0 C--N 1.327 -0.371 0 CA-C-O 120.845 0.355 . . . . 0.0 110.623 179.234 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo . . . . . 0 N--CA 1.463 -0.268 0 CA-C-O 120.528 0.137 . . . . 0.0 112.279 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . 0.665 ' C ' HD12 ' A' ' 38' ' ' ILE . 2.1 t-160 -133.95 133.71 41.7 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 121.053 -0.259 . . . . 0.0 110.492 179.634 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.665 HD12 ' C ' ' A' ' 37' ' ' HIS . 3.1 mp -129.43 129.52 67.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.895 0.379 . . . . 0.0 111.155 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.572 ' C ' HD22 ' A' ' 40' ' ' LEU . 3.9 mp -118.09 140.47 41.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.404 179.511 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.572 HD22 ' C ' ' A' ' 39' ' ' ILE . 3.5 mm? -117.91 126.66 52.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.951 0.405 . . . . 0.0 111.161 -179.636 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -123.68 -172.88 2.62 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.379 179.638 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.456 ' CE ' ' CE2' ' A' ' 47' ' ' PHE . 13.4 tttm -172.95 146.73 1.56 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.197 0.522 . . . . 0.0 111.003 -179.803 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.427 ' HB3' ' HD2' ' A' ' 44' ' ' PRO . 43.7 mt-10 -132.33 166.79 26.12 Favored Pre-proline 0 C--N 1.323 -0.583 0 CA-C-N 115.428 -0.805 . . . . 0.0 109.153 179.054 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . 0.427 ' HD2' ' HB3' ' A' ' 43' ' ' GLU . 73.7 Cg_exo -50.05 -19.75 4.45 Favored 'Trans proline' 0 N--CA 1.464 -0.236 0 C-N-CA 121.678 1.586 . . . . 0.0 112.365 -179.529 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.75 -76.25 0.34 Allowed 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 115.575 -0.738 . . . . 0.0 110.328 179.317 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . 0.452 ' HA3' ' HA ' ' A' ' 67' ' ' GLU . . . -142.72 -158.74 7.66 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.751 -179.301 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.456 ' CE2' ' CE ' ' A' ' 42' ' ' LYS . 24.2 m-85 -107.35 151.19 25.83 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 121.577 0.703 . . . . 0.0 112.433 -179.298 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.59 HG22 ' CB ' ' A' ' 65' ' ' LYS . 78.7 t -126.0 139.78 50.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 114.712 -1.131 . . . . 0.0 110.577 -179.881 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.443 ' O ' ' HA ' ' A' ' 63' ' ' SER . . . -131.03 124.44 30.88 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.642 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -120.07 148.66 43.31 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.694 0.283 . . . . 0.0 110.737 -179.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.802 ' CB ' HD11 ' A' ' 76' ' ' LEU . . . -145.11 142.08 29.36 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.976 0.417 . . . . 0.0 111.399 179.925 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 4.0 m -133.84 132.03 39.92 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.78 179.466 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.588 ' O ' HG13 ' A' ' 59' ' ' VAL . 13.2 mt -133.81 136.78 53.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.996 0.426 . . . . 0.0 111.516 -179.377 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -100.83 144.32 29.93 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.54 179.011 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.441 ' HB ' ' CD ' ' A' ' 56' ' ' PRO . 24.4 p -136.3 168.68 16.08 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.735 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.441 ' CD ' ' HB ' ' A' ' 55' ' ' THR . 10.4 Cg_exo -71.84 -12.98 29.15 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.843 2.362 . . . . 0.0 112.705 -179.858 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -130.15 21.36 5.3 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 112.038 0.384 . . . . 0.0 112.038 -179.368 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 150.52 -164.79 29.9 Favored Glycine 0 C--N 1.33 0.223 0 C-N-CA 120.082 -1.056 . . . . 0.0 113.334 179.682 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.588 HG13 ' O ' ' A' ' 53' ' ' ILE . 12.8 t -141.7 146.55 22.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.687 0.279 . . . . 0.0 110.921 -179.868 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.568 HD22 ' HB3' ' A' ' 83' ' ' GLN . 2.8 mt -119.11 147.44 44.16 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.871 0.367 . . . . 0.0 111.271 -179.679 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 9.2 p -141.18 147.37 22.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.018 179.898 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.616 ' O ' HD12 ' A' ' 76' ' ' LEU . . . -155.23 154.41 32.15 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.078 0.466 . . . . 0.0 111.333 -179.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . 0.443 ' HA ' ' O ' ' A' ' 49' ' ' ALA . 3.1 p -146.56 153.99 41.0 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.737 -179.41 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.755 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -147.47 107.03 0.37 Allowed Glycine 0 C--N 1.333 0.386 0 N-CA-C 111.496 -0.642 . . . . 0.0 111.496 179.199 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.59 ' CB ' HG22 ' A' ' 48' ' ' VAL . 13.6 mtpt -107.24 44.75 1.04 Allowed 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 -178.701 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.617 ' ND1' HG21 ' A' ' 71' ' ' THR . 12.8 t-80 -76.77 155.65 32.97 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.81 0.338 . . . . 0.0 110.292 178.688 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.452 ' HA ' ' HA3' ' A' ' 46' ' ' GLY . 1.3 mm-40 -61.64 -26.29 67.91 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.823 0.344 . . . . 0.0 111.185 179.819 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -98.09 123.69 42.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.367 -179.558 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 6.1 ttt -47.63 -47.43 29.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.773 -0.648 . . . . 0.0 111.796 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -66.46 -38.71 87.95 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.861 -179.016 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.617 HG21 ' ND1' ' A' ' 66' ' ' HIS . 87.8 m -63.84 -42.01 97.69 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.707 0.289 . . . . 0.0 110.76 -179.749 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.755 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -61.64 -49.0 78.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.541 179.678 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.525 HG21 HG22 ' A' ' 19' ' ' VAL . 23.1 mt -59.91 -47.54 91.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.788 179.715 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -63.39 -37.74 88.44 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.604 179.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -65.64 -44.1 87.46 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.575 179.57 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.802 HD11 ' CB ' ' A' ' 51' ' ' ALA . 0.3 OUTLIER -54.49 -56.8 15.1 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.269 179.323 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.749 ' CG2' HD11 ' A' ' 26' ' ' LEU . 14.1 mm -57.66 -30.31 36.78 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.493 -0.322 . . . . 0.0 110.133 179.044 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -58.32 -36.32 73.2 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.474 0.654 . . . . 0.0 109.694 178.534 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.6 ' HB2' ' HB1' ' A' ' 62' ' ' ALA . 5.7 mmtm -76.29 -30.06 57.61 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.853 -1.067 . . . . 0.0 110.375 179.365 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.559 HD22 HD12 ' A' ' 53' ' ' ILE . 31.4 mt -60.33 -49.68 76.62 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 177.477 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -61.44 -43.16 99.36 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 114.207 -1.361 . . . . 0.0 110.091 177.278 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.42 -30.6 71.34 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.55 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.568 ' HB3' HD22 ' A' ' 60' ' ' LEU . 34.2 mt-30 -76.35 -40.21 51.85 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.015 0.436 . . . . 0.0 110.48 179.486 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 6.5 mt -64.98 -30.76 71.77 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.646 179.684 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 -64.3 -52.66 57.45 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.551 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 6.9 mmtm . . . . . 0 C--N 1.328 -0.334 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.48 179.52 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . 0.859 ' HE1' HD11 ' A' ' 4' ' ' ILE . 8.4 tmm? . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.899 0.381 . . . . 0.0 110.886 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -103.0 124.87 49.33 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.19 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.859 HD11 ' HE1' ' A' ' 2' ' ' MET . 34.5 mt -109.89 124.01 66.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.873 179.786 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.8 p -134.09 156.7 47.81 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.059 179.741 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 22.0 p -164.37 139.79 5.89 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.614 -179.754 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 6.2 mtmp? -101.55 35.5 2.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.809 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -141.94 -50.23 0.39 Allowed 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.755 179.823 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 17.5 mtm -119.01 177.9 4.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.857 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 -104.52 164.96 11.38 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.736 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.482 HG22 ' HG3' ' A' ' 16' ' ' ARG . 4.8 mm -90.02 112.35 24.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 121.088 0.471 . . . . 0.0 111.009 -179.678 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.41 ' H ' HD12 ' A' ' 15' ' ' ILE . 19.3 p -98.92 148.69 34.91 Favored Pre-proline 0 C--N 1.326 -0.419 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.018 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_exo -55.3 -21.06 27.53 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.325 2.017 . . . . 0.0 111.69 179.148 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -76.12 -42.81 45.82 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.051 0.453 . . . . 0.0 110.317 179.255 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.622 ' O ' HG23 ' A' ' 19' ' ' VAL . 24.6 mt -72.41 -29.02 29.92 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.34 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.489 178.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.482 ' HG3' HG22 ' A' ' 11' ' ' ILE . 79.4 mtt180 -74.67 -45.19 46.19 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.575 -0.739 . . . . 0.0 109.74 178.773 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 3.3 tm0? -67.38 -38.89 85.44 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.564 179.022 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.487 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 78.3 t60 -59.75 -60.58 3.61 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 178.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.622 HG23 ' O ' ' A' ' 15' ' ' ILE . 15.1 t -60.45 -46.94 94.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 C-N-CA 121.014 -0.274 . . . . 0.0 110.31 178.733 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.69 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -58.1 -41.58 83.81 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.887 179.7 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.487 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 0.9 OUTLIER -59.59 -34.37 72.64 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.006 0.431 . . . . 0.0 110.064 179.9 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 9.0 mmt180 -74.81 -25.98 59.41 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.747 179.551 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.69 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 10.1 mt -68.85 -57.41 5.59 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.285 0.564 . . . . 0.0 110.521 179.388 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.15 -25.76 65.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.291 -0.868 . . . . 0.0 111.566 -179.777 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 10.1 tppt? -78.64 -32.57 47.37 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.039 0.447 . . . . 0.0 110.29 179.674 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 44.4 mt . . . . . 0 C--N 1.327 -0.379 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.836 -179.957 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.514 ' HB3' HG23 ' A' ' 53' ' ' ILE . 72.4 Cg_endo . . . . . 0 N--CA 1.465 -0.161 0 CA-C-O 120.72 0.217 . . . . 0.0 111.896 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . 0.497 ' O ' HD13 ' A' ' 38' ' ' ILE . 1.5 t-160 -137.36 131.11 31.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.043 0.449 . . . . 0.0 111.369 -179.596 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.709 HD12 ' CB ' ' A' ' 51' ' ' ALA . 8.5 mm -121.0 134.31 64.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.703 179.766 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.42 ' O ' HD23 ' A' ' 40' ' ' LEU . 23.3 mt -120.85 142.27 37.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.026 -179.853 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.42 HD23 ' O ' ' A' ' 39' ' ' ILE . 10.3 mt -121.29 128.31 52.21 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.78 -179.973 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.3 m -124.65 -171.53 2.37 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.492 179.813 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.408 ' HG3' ' CD2' ' A' ' 47' ' ' PHE . 7.5 ttpp -160.41 141.18 11.88 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.339 0.59 . . . . 0.0 111.353 -179.739 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -131.49 157.47 78.04 Favored Pre-proline 0 C--N 1.322 -0.593 0 CA-C-N 115.089 -0.959 . . . . 0.0 109.27 179.25 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_exo -52.41 -24.49 21.8 Favored 'Trans proline' 0 N--CA 1.464 -0.235 0 C-N-CA 121.808 1.672 . . . . 0.0 112.371 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -89.48 -6.83 56.1 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.433 -0.803 . . . . 0.0 112.766 -179.081 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 150.12 -163.87 29.55 Favored Glycine 0 C--O 1.224 -0.493 0 C-N-CA 120.239 -0.982 . . . . 0.0 112.16 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.408 ' CD2' ' HG3' ' A' ' 42' ' ' LYS . 18.7 m-85 -109.19 154.02 22.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.529 0.68 . . . . 0.0 111.959 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.563 HG22 ' CB ' ' A' ' 65' ' ' LYS . 74.6 t -127.72 139.73 51.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 114.858 -1.065 . . . . 0.0 111.042 -179.204 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -130.94 122.83 27.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.38 179.481 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -118.64 149.48 41.32 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.709 0.29 . . . . 0.0 110.807 -179.813 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.709 ' CB ' HD12 ' A' ' 38' ' ' ILE . . . -144.31 139.38 28.52 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.234 179.787 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.7 m -133.78 131.44 39.33 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 179.393 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.706 ' O ' HG13 ' A' ' 59' ' ' VAL . 19.0 mt -133.05 136.6 55.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 121.146 0.498 . . . . 0.0 111.729 -179.226 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -101.79 119.06 38.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.688 179.38 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 9.3 p -112.46 155.89 43.06 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.529 179.717 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -63.01 -14.08 39.24 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.521 2.148 . . . . 0.0 112.576 -179.806 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 61.8 m-80 -120.38 22.23 11.38 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 111.709 0.262 . . . . 0.0 111.709 -179.605 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 139.33 -167.14 25.32 Favored Glycine 0 N--CA 1.453 -0.212 0 C-N-CA 120.446 -0.883 . . . . 0.0 112.85 179.707 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.706 HG13 ' O ' ' A' ' 53' ' ' ILE . 16.6 t -137.59 142.33 36.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.82 0.343 . . . . 0.0 111.04 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.598 HD12 ' C ' ' A' ' 59' ' ' VAL . 7.6 mp -116.34 153.54 31.81 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.104 -179.84 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 21.6 t -140.26 147.15 23.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.067 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -153.77 151.69 29.86 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.023 0.439 . . . . 0.0 111.576 -179.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -145.18 155.24 43.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.664 -179.342 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.698 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -148.67 104.53 0.28 Allowed Glycine 0 C--N 1.333 0.367 0 N-CA-C 111.399 -0.681 . . . . 0.0 111.399 179.32 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.563 ' CB ' HG22 ' A' ' 48' ' ' VAL . 10.7 mttm -106.87 45.5 0.98 Allowed 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -178.604 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.535 ' ND1' HG21 ' A' ' 71' ' ' THR . 14.6 t-80 -75.47 156.26 35.4 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 178.474 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -59.97 -27.56 66.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.752 0.311 . . . . 0.0 111.218 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -97.97 119.89 37.41 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.985 0.421 . . . . 0.0 111.475 -179.343 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . 0.437 ' HE1' HD13 ' A' ' 15' ' ' ILE . 1.2 ttt -47.73 -46.27 29.71 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.502 179.732 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 45.6 m-85 -66.57 -39.51 88.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.127 -179.556 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.535 HG21 ' ND1' ' A' ' 66' ' ' HIS . 92.4 m -65.42 -38.56 90.27 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.668 179.87 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.698 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -62.03 -50.64 71.23 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.825 179.772 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.459 HG21 HG22 ' A' ' 19' ' ' VAL . 7.3 mt -61.34 -42.01 92.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.698 0.285 . . . . 0.0 110.249 179.518 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -64.53 -40.74 96.17 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.13 0.491 . . . . 0.0 109.965 178.862 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -65.41 -44.58 87.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.57 179.438 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.607 HD11 ' N ' ' A' ' 51' ' ' ALA . 0.3 OUTLIER -52.38 -59.91 3.85 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 179.119 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.573 HD13 HD12 ' A' ' 80' ' ' LEU . 1.9 mm -55.92 -28.7 24.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 178.503 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.52 -41.69 90.55 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.395 0.617 . . . . 0.0 109.433 178.243 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.32 -30.87 65.17 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.987 -1.006 . . . . 0.0 110.191 178.898 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.624 ' O ' HD12 ' A' ' 84' ' ' LEU . 96.9 mt -62.74 -46.51 87.72 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 177.43 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.27 -45.7 92.4 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 114.674 -1.148 . . . . 0.0 110.253 177.556 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.97 -35.71 81.59 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.529 -179.528 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -73.65 -46.87 44.08 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.893 0.378 . . . . 0.0 110.361 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.624 HD12 ' O ' ' A' ' 80' ' ' LEU . 1.5 mt -64.69 -27.67 69.08 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.405 179.387 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -61.15 -46.98 88.32 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.151 -179.575 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 5.4 mtmm . . . . . 0 C--N 1.326 -0.456 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.976 179.649 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . 0.769 ' HG3' HD11 ' A' ' 23' ' ' LEU . 6.1 tmm? . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.835 0.35 . . . . 0.0 110.909 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -120.34 124.38 45.41 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.165 -179.863 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 49.2 mt -120.39 125.95 74.72 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.849 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -132.87 160.66 36.33 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.986 179.729 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.405 ' HB3' ' HB2' ' A' ' 40' ' ' LEU . 21.9 p -163.35 142.02 8.14 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.745 -179.468 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.7 mmtm -103.92 16.15 26.98 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.353 -179.795 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 17.6 mt-30 -141.92 23.02 2.09 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 120.791 0.329 . . . . 0.0 111.031 179.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 176.46 -178.26 0.15 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.654 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -121.12 163.04 19.02 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.784 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 3.8 mm -91.18 118.19 35.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.937 0.398 . . . . 0.0 110.877 -179.748 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.493 ' H ' HD12 ' A' ' 15' ' ' ILE . 19.2 p -100.21 159.26 30.27 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.871 179.739 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.431 ' HA ' ' HG2' ' A' ' 16' ' ' ARG . 24.1 Cg_exo -62.58 -13.3 32.73 Favored 'Trans proline' 0 C--N 1.344 0.291 0 C-N-CA 122.611 2.207 . . . . 0.0 112.215 179.479 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -90.23 -38.59 13.33 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.025 0.441 . . . . 0.0 110.678 179.537 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.493 HD12 ' H ' ' A' ' 12' ' ' THR . 19.3 mt -72.89 -32.38 39.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.758 -0.656 . . . . 0.0 109.513 179.194 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.431 ' HG2' ' HA ' ' A' ' 13' ' ' PRO . 23.2 ptt180 -71.54 -45.73 61.53 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.538 178.86 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.41 ' N ' ' CG ' ' A' ' 16' ' ' ARG . 6.0 tp-100 -67.02 -35.85 80.82 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.492 179.014 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.453 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 68.0 t60 -58.3 -64.03 1.06 Allowed 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 178.682 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.946 HG13 HD11 ' A' ' 77' ' ' ILE . 15.2 t -61.43 -45.32 98.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.663 178.866 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.633 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -55.52 -49.28 73.04 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.678 179.751 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.453 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 3.0 p30 -59.13 -29.24 67.26 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.822 0.344 . . . . 0.0 110.641 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 41.8 mmt180 -74.77 -28.03 60.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.528 179.339 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.769 HD11 ' HG3' ' A' ' 2' ' ' MET . 1.3 mt -68.85 -48.55 63.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.964 0.412 . . . . 0.0 110.102 178.794 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.97 -26.25 65.86 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.793 179.473 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 15.6 tttp -78.51 -32.04 47.89 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.649 179.492 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.642 HD23 ' OE2' ' A' ' 81' ' ' GLU . 5.4 mt . . . . . 0 C--N 1.327 -0.377 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.713 179.695 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.725 ' HB3' HG23 ' A' ' 53' ' ' ILE . 94.5 Cg_endo . . . . . 0 N--CA 1.454 -0.847 0 N-CA-C 109.92 -0.838 . . . . 0.0 109.92 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . 0.568 ' C ' HD13 ' A' ' 38' ' ' ILE . 0.5 OUTLIER -98.63 130.47 45.15 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -177.877 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.626 HD12 ' HB1' ' A' ' 51' ' ' ALA . 5.5 mm -121.48 132.65 70.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.342 -0.844 . . . . 0.0 109.766 178.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 26.6 mt -119.96 148.08 23.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 121.0 0.428 . . . . 0.0 111.868 -179.232 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.405 ' HB2' ' HB3' ' A' ' 6' ' ' SER . 4.6 mt -123.38 127.18 48.1 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.629 179.59 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -124.8 -170.76 2.22 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.725 -179.889 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.459 ' HA ' ' HA ' ' A' ' 47' ' ' PHE . 1.6 tttp -170.5 145.05 2.53 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.304 0.574 . . . . 0.0 110.932 -179.786 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.456 ' N ' ' HG2' ' A' ' 42' ' ' LYS . 3.3 mm-40 -130.24 163.87 44.88 Favored Pre-proline 0 C--N 1.323 -0.576 0 CA-C-N 115.457 -0.792 . . . . 0.0 108.927 178.871 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . 0.422 ' HD2' ' HB3' ' A' ' 43' ' ' GLU . 5.0 Cg_endo -48.14 -21.96 3.32 Favored 'Trans proline' 0 N--CA 1.463 -0.287 0 C-N-CA 122.073 1.848 . . . . 0.0 112.166 -179.359 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -83.73 -75.15 0.34 Allowed 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.212 179.291 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . 0.469 ' HA3' ' HA ' ' A' ' 67' ' ' GLU . . . -143.89 -156.67 6.88 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.814 -179.31 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.459 ' HA ' ' HA ' ' A' ' 42' ' ' LYS . 22.8 m-85 -107.69 151.38 25.75 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.654 0.74 . . . . 0.0 112.476 -179.32 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.545 HG13 ' HG2' ' A' ' 65' ' ' LYS . 78.6 t -124.46 140.93 46.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 114.525 -1.216 . . . . 0.0 110.424 -179.875 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.439 ' O ' ' HA ' ' A' ' 63' ' ' SER . . . -132.08 125.1 30.55 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.64 -0.255 . . . . 0.0 110.922 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 -117.77 148.58 41.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.465 179.652 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.728 ' HB2' HD21 ' A' ' 76' ' ' LEU . . . -144.58 142.52 30.23 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.968 0.413 . . . . 0.0 111.771 -179.802 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.1 m -135.26 131.32 36.45 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.839 179.334 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.725 HG23 ' HB3' ' A' ' 36' ' ' PRO . 21.3 mt -133.35 138.84 50.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.119 0.485 . . . . 0.0 111.842 -179.159 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 18.9 m120 -102.28 119.18 38.37 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.648 179.3 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.501 ' HB ' ' HD2' ' A' ' 56' ' ' PRO . 6.1 p -113.82 162.35 23.14 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.295 179.673 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.501 ' HD2' ' HB ' ' A' ' 55' ' ' THR . 68.9 Cg_endo -76.22 -3.17 13.49 Favored 'Trans proline' 0 N--CA 1.463 -0.318 0 C-N-CA 122.211 1.94 . . . . 0.0 112.517 -179.857 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -129.63 23.47 5.44 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.202 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 140.4 -167.4 25.52 Favored Glycine 0 C--N 1.33 0.239 0 C-N-CA 120.54 -0.838 . . . . 0.0 112.778 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 21.3 t -131.55 147.27 32.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.766 0.317 . . . . 0.0 111.11 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 13.0 mt -120.65 141.97 49.87 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.29 -179.767 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 21.7 t -141.21 139.96 32.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.758 179.74 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.539 ' HB1' ' HB2' ' A' ' 79' ' ' LYS . . . -151.42 159.5 44.2 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.296 0.569 . . . . 0.0 111.857 -179.557 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . 0.439 ' HA ' ' O ' ' A' ' 49' ' ' ALA . 2.4 p -145.58 154.89 42.66 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.281 -0.872 . . . . 0.0 111.678 -179.306 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.715 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -148.31 105.05 0.3 Allowed Glycine 0 C--N 1.332 0.358 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.551 179.341 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.545 ' HG2' HG13 ' A' ' 48' ' ' VAL . 5.3 mttp -105.97 44.9 1.0 Allowed 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 112.401 0.519 . . . . 0.0 112.401 -178.683 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.634 ' ND1' HG21 ' A' ' 71' ' ' THR . 12.6 t-80 -76.64 155.69 33.26 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.757 0.313 . . . . 0.0 110.309 178.582 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.469 ' HA ' ' HA3' ' A' ' 46' ' ' GLY . 10.8 mt-10 -61.63 -26.34 67.94 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.787 0.327 . . . . 0.0 111.223 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -97.61 122.63 40.91 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.083 0.468 . . . . 0.0 111.475 -179.364 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . 0.565 ' HE3' HD11 ' A' ' 73' ' ' ILE . 0.9 OUTLIER -47.71 -49.91 26.59 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.772 179.955 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 40.3 m-85 -66.19 -37.45 85.63 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.711 -179.087 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.634 HG21 ' ND1' ' A' ' 66' ' ' HIS . 94.1 m -64.22 -41.61 96.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.774 0.321 . . . . 0.0 110.655 -179.859 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.715 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -61.83 -47.91 82.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.491 179.455 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.565 HD11 ' HE3' ' A' ' 69' ' ' MET . 31.0 mt -60.19 -48.08 89.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.624 179.715 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -64.05 -39.78 94.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.752 179.767 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -65.12 -44.34 89.03 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.536 179.678 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.728 HD21 ' HB2' ' A' ' 51' ' ' ALA . 0.3 OUTLIER -54.21 -57.6 10.54 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.504 -0.317 . . . . 0.0 110.373 179.397 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.946 HD11 HG13 ' A' ' 19' ' ' VAL . 61.6 mt -56.63 -30.88 33.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 N-CA-C 110.162 -0.311 . . . . 0.0 110.162 179.218 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -58.66 -36.55 74.32 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.513 0.673 . . . . 0.0 109.571 178.403 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.539 ' HB2' ' HB1' ' A' ' 62' ' ' ALA . 0.0 OUTLIER -75.6 -28.04 58.75 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.8 -1.091 . . . . 0.0 110.024 179.258 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.639 ' O ' HD12 ' A' ' 84' ' ' LEU . 77.7 mt -62.79 -49.6 74.34 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 177.438 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.642 ' OE2' HD23 ' A' ' 26' ' ' LEU . 3.4 tt0 -62.68 -46.13 89.6 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 114.293 -1.321 . . . . 0.0 110.744 177.87 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.74 -37.53 86.93 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.939 -179.433 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 44.3 mt-30 -75.71 -37.7 59.2 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.884 0.373 . . . . 0.0 110.803 179.88 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.639 HD12 ' O ' ' A' ' 80' ' ' LEU . 2.2 mt -64.24 -25.37 68.03 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.695 179.668 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -64.15 -28.0 69.46 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.538 179.661 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 16.2 mmtt . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.102 179.989 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . 0.493 ' CE ' ' HB2' ' A' ' 20' ' ' ALA . 3.2 mpp? . . . . . 0 C--O 1.232 0.143 0 CA-C-O 120.847 0.356 . . . . 0.0 110.916 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . 0.406 ' HB3' ' CD2' ' A' ' 37' ' ' HIS . 2.8 m120 -122.91 114.27 20.22 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.26 -179.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 36.4 mt -123.55 123.86 68.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.68 179.617 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -134.99 157.5 46.78 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.998 0.428 . . . . 0.0 111.366 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 22.4 p -164.69 139.59 5.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.436 -179.761 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -102.03 25.31 8.9 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.188 -179.736 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -140.89 15.53 2.3 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.164 179.648 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER 173.72 -177.33 0.08 Allowed 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.984 0.421 . . . . 0.0 110.74 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -110.69 172.51 6.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.651 179.838 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.8 mm -91.01 113.22 26.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 121.009 0.433 . . . . 0.0 111.173 -179.579 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 12.5 p -98.83 157.39 34.24 Favored Pre-proline 0 C--N 1.327 -0.405 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.959 179.809 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.429 ' HA ' ' HG2' ' A' ' 16' ' ' ARG . 23.9 Cg_exo -62.55 -13.51 33.9 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.579 2.186 . . . . 0.0 111.984 179.204 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -86.1 -41.01 15.11 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.058 0.456 . . . . 0.0 110.428 179.397 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.702 ' O ' HG23 ' A' ' 19' ' ' VAL . 24.5 mt -72.7 -29.29 29.72 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.29 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.813 179.265 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.429 ' HG2' ' HA ' ' A' ' 13' ' ' PRO . 2.2 ptm180 -74.99 -43.4 54.15 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.868 -0.605 . . . . 0.0 109.544 178.935 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -67.39 -37.94 83.91 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.696 178.922 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.463 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 82.1 t60 -60.63 -53.65 54.86 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 178.55 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.798 ' O ' ' HG3' ' A' ' 22' ' ' ARG . 23.9 t -62.55 -49.28 84.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.209 178.312 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.551 ' HA ' ' CG ' ' A' ' 23' ' ' LEU . . . -55.65 -37.91 68.85 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.759 -0.376 . . . . 0.0 111.875 179.762 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.463 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 0.9 OUTLIER -64.37 -32.53 74.18 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.37 -0.532 . . . . 0.0 110.477 179.335 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.798 ' HG3' ' O ' ' A' ' 19' ' ' VAL . 0.0 OUTLIER -77.9 -39.72 42.14 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.914 -0.585 . . . . 0.0 112.486 -179.283 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.65 ' CD2' HG12 ' A' ' 19' ' ' VAL . 0.0 OUTLIER -65.24 -48.51 73.04 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 120.034 -0.666 . . . . 0.0 110.843 -179.463 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.31 -24.79 66.68 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.15 179.556 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 2.9 tppp? -79.14 -34.29 43.39 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.854 179.888 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.563 HD12 ' HD2' ' A' ' 22' ' ' ARG . 0.8 OUTLIER . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.908 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.403 ' HB3' HG23 ' A' ' 53' ' ' ILE . 69.4 Cg_endo . . . . . 0 N--CA 1.463 -0.289 0 N-CA-C 111.433 -0.257 . . . . 0.0 111.433 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . 0.406 ' CD2' ' HB3' ' A' ' 3' ' ' ASN . 2.2 t-160 -134.4 130.97 37.65 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.125 0.488 . . . . 0.0 111.635 -179.455 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 9.1 mm -120.13 133.76 65.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.388 179.495 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 2.1 mp -119.11 146.26 24.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.002 -179.815 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 45.8 mt -124.13 126.85 46.88 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.888 179.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -123.65 -173.93 2.86 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.398 179.696 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.409 ' HG3' ' CD2' ' A' ' 47' ' ' PHE . 15.1 tttt -159.7 140.66 12.45 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.425 0.631 . . . . 0.0 111.489 -179.667 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -131.58 156.82 79.62 Favored Pre-proline 0 C--N 1.323 -0.566 0 CA-C-N 114.934 -1.03 . . . . 0.0 109.195 179.15 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_exo -52.12 -24.47 20.15 Favored 'Trans proline' 0 N--CA 1.465 -0.183 0 C-N-CA 121.854 1.703 . . . . 0.0 112.418 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -89.64 -6.71 55.93 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.499 -0.773 . . . . 0.0 112.833 -179.178 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 149.94 -164.35 29.57 Favored Glycine 0 C--O 1.224 -0.503 0 C-N-CA 120.214 -0.993 . . . . 0.0 112.154 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.41 ' CD1' ' N ' ' A' ' 47' ' ' PHE . 18.3 m-85 -108.35 153.63 22.99 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.57 0.7 . . . . 0.0 111.854 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.623 HG22 ' CG ' ' A' ' 65' ' ' LYS . 54.1 t -127.36 140.7 48.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 114.82 -1.082 . . . . 0.0 111.023 -179.281 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -131.84 124.11 28.92 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.677 179.682 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 67.8 m-20 -118.89 147.33 44.11 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.685 0.278 . . . . 0.0 110.743 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.6 ' CB ' HD11 ' A' ' 76' ' ' LEU . . . -144.97 141.19 28.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.875 0.369 . . . . 0.0 111.547 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.629 ' O ' HD13 ' A' ' 53' ' ' ILE . 6.4 m -135.29 133.49 38.94 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.361 179.576 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.648 ' O ' HG13 ' A' ' 59' ' ' VAL . 1.1 mm -132.31 134.38 59.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.843 0.354 . . . . 0.0 111.13 -179.825 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 23.7 m120 -103.24 118.29 36.45 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.438 179.026 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 30.3 p -113.61 153.98 45.73 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.877 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_exo -61.87 -15.46 43.02 Favored 'Trans proline' 0 C--N 1.343 0.263 0 C-N-CA 122.564 2.176 . . . . 0.0 112.655 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 -118.89 21.98 12.17 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.616 -0.265 . . . . 0.0 111.691 -179.546 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 141.84 -165.46 26.52 Favored Glycine 0 C--N 1.33 0.243 0 C-N-CA 120.376 -0.916 . . . . 0.0 113.053 179.756 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.648 HG13 ' O ' ' A' ' 53' ' ' ILE . 12.5 t -142.24 142.29 27.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.822 0.344 . . . . 0.0 111.02 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -117.64 148.99 41.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.192 -179.792 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 12.4 t -138.87 145.6 27.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.874 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.479 ' O ' HD12 ' A' ' 76' ' ' LEU . . . -153.43 150.97 29.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.168 0.509 . . . . 0.0 111.604 -179.723 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 11.5 p -143.04 158.7 43.36 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.643 -179.41 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.56 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -153.46 109.77 0.42 Allowed Glycine 0 C--N 1.33 0.232 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.61 179.639 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.623 ' CG ' HG22 ' A' ' 48' ' ' VAL . 60.7 mttt -110.68 45.14 1.17 Allowed 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -178.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 12.3 t-80 -75.79 156.36 34.61 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 110.207 -0.294 . . . . 0.0 110.207 178.543 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -61.1 -26.7 67.84 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.72 0.295 . . . . 0.0 111.295 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -98.53 120.8 39.57 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.023 0.439 . . . . 0.0 111.371 -179.378 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 13.2 ttt -48.04 -50.72 26.94 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.953 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -65.56 -40.23 92.6 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.268 -179.296 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 37.9 m -64.74 -40.44 95.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.801 0.334 . . . . 0.0 110.679 179.891 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.56 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -62.17 -49.36 76.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.648 179.506 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 12.9 mt -60.4 -45.1 97.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.878 0.37 . . . . 0.0 110.266 179.512 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -64.45 -37.82 88.85 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.261 179.264 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -65.85 -42.23 90.71 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.183 179.233 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.6 HD11 ' CB ' ' A' ' 51' ' ' ALA . 0.3 OUTLIER -53.57 -56.24 18.78 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 178.4 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.54 HD13 ' CG ' ' A' ' 22' ' ' ARG . 37.4 mt -56.79 -30.63 33.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.17 178.493 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -57.93 -35.77 71.55 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.548 0.69 . . . . 0.0 109.305 178.241 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.3 mptp? -78.92 -31.27 45.16 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 114.7 -1.136 . . . . 0.0 110.208 179.065 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.501 HD12 ' HA ' ' A' ' 77' ' ' ILE . 76.4 mt -63.07 -50.39 70.76 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 177.775 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -60.46 -47.6 85.42 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 114.942 -1.027 . . . . 0.0 110.22 177.522 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 59.7 mtt180 -62.96 -24.57 67.95 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.819 179.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 7.2 mt-30 -75.44 -44.24 45.4 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.615 179.757 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 28.3 mt -64.79 -27.4 68.86 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.835 179.866 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -63.55 -33.06 74.76 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.018 0.437 . . . . 0.0 110.549 179.75 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 18.6 mmtt . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.966 179.907 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . 0.722 ' CE ' HD11 ' A' ' 4' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.812 0.339 . . . . 0.0 111.054 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -116.7 136.43 52.97 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.483 -179.497 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.722 HD11 ' CE ' ' A' ' 2' ' ' MET . 34.7 mt -126.27 125.39 67.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.408 179.386 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.455 ' OG1' HD13 ' A' ' 39' ' ' ILE . 2.9 p -134.35 161.2 35.65 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.869 0.366 . . . . 0.0 111.18 179.949 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 29.1 p -163.38 138.3 6.33 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.551 -179.45 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 20.3 mttt -101.74 31.48 3.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.931 -179.769 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -141.19 -47.48 0.39 Allowed 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.805 179.743 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 1.5 mpp? -120.37 -170.36 1.97 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.748 179.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -118.41 164.96 14.47 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.572 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.467 ' CD1' HG22 ' A' ' 4' ' ' ILE . 4.1 mm -89.95 115.1 28.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 121.073 0.463 . . . . 0.0 110.945 -179.576 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.546 ' H ' HD12 ' A' ' 15' ' ' ILE . 20.1 p -100.35 155.81 35.97 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.924 179.79 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_exo -59.56 -17.51 42.03 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.39 2.06 . . . . 0.0 111.822 179.147 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.01 -40.47 22.06 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-O 121.108 0.48 . . . . 0.0 110.226 179.21 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.546 HD12 ' H ' ' A' ' 12' ' ' THR . 19.1 mt -73.42 -28.72 25.88 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.594 179.019 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.57 -45.01 48.12 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.169 178.819 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 42.9 tt0 -67.74 -37.32 82.01 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.371 178.809 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.427 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 57.6 t60 -59.29 -60.02 4.53 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 178.648 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.544 HG23 ' O ' ' A' ' 15' ' ' ILE . 21.3 t -60.77 -45.36 97.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 110.142 -0.318 . . . . 0.0 110.142 178.396 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.681 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -57.65 -42.07 82.72 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.538 179.394 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.427 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 0.9 OUTLIER -59.67 -33.23 71.29 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 121.075 0.464 . . . . 0.0 110.043 179.607 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 19.8 mmm180 -74.15 -26.07 60.1 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.516 179.316 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.681 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 14.7 mt -66.44 -53.12 39.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.016 0.436 . . . . 0.0 109.942 178.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.77 -22.25 63.89 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.757 179.057 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 6.5 tptp -78.8 -28.08 44.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.15 179.191 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 33.5 mt . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.824 -179.844 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.457 ' HG2' ' HA ' ' A' ' 2' ' ' MET . 19.4 Cg_endo . . . . . 0 C--O 1.231 0.155 0 CA-C-O 120.356 0.065 . . . . 0.0 112.052 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -140.11 126.95 20.63 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.549 -0.46 . . . . 0.0 111.865 -179.814 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.638 ' N ' HD12 ' A' ' 38' ' ' ILE . 3.4 mp -119.34 138.35 50.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.418 179.323 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.455 HD13 ' OG1' ' A' ' 5' ' ' THR . 22.1 mm -116.05 148.38 18.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.46 -179.485 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 11.0 mt -122.88 127.19 48.65 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.518 179.615 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 11.7 m -125.33 -171.16 2.31 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.789 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.46 ' HA ' ' HA ' ' A' ' 47' ' ' PHE . 5.2 ttpt -173.58 146.63 1.34 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.128 0.49 . . . . 0.0 110.765 -179.791 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.443 ' HB3' ' HD2' ' A' ' 44' ' ' PRO . 2.1 mt-10 -132.04 170.5 11.15 Favored Pre-proline 0 C--N 1.324 -0.506 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.299 179.228 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . 0.443 ' HD2' ' HB3' ' A' ' 43' ' ' GLU . 69.0 Cg_exo -51.45 -19.7 7.43 Favored 'Trans proline' 0 N--CA 1.464 -0.241 0 C-N-CA 121.727 1.618 . . . . 0.0 112.302 -179.502 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.12 -77.95 0.29 Allowed 'General case' 0 N--CA 1.445 -0.724 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.104 179.344 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . 0.452 ' HA3' ' HA ' ' A' ' 67' ' ' GLU . . . -141.77 -155.68 6.55 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.859 -179.309 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.46 ' HA ' ' HA ' ' A' ' 42' ' ' LYS . 21.9 m-85 -108.94 151.13 26.72 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-O 121.639 0.733 . . . . 0.0 112.699 -179.232 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.519 HG22 ' CB ' ' A' ' 65' ' ' LYS . 75.7 t -124.98 141.45 45.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 114.482 -1.236 . . . . 0.0 110.517 -179.659 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.402 ' O ' ' HA ' ' A' ' 63' ' ' SER . . . -132.44 124.09 27.94 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.654 -0.248 . . . . 0.0 110.797 179.787 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 21.2 m-20 -119.04 149.19 42.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.602 -0.272 . . . . 0.0 110.547 179.858 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.467 ' N ' HD11 ' A' ' 76' ' ' LEU . . . -146.69 140.42 25.92 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.829 0.347 . . . . 0.0 111.317 179.849 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.6 m -135.12 131.56 37.02 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.033 179.402 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.675 ' O ' HG13 ' A' ' 59' ' ' VAL . 17.4 mt -133.33 136.4 54.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 121.013 0.435 . . . . 0.0 111.456 -179.547 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -103.6 131.28 50.88 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.148 178.963 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.573 ' HB ' ' HD2' ' A' ' 56' ' ' PRO . 5.8 p -127.83 163.33 43.98 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.444 -179.904 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.573 ' HD2' ' HB ' ' A' ' 55' ' ' THR . 53.6 Cg_endo -70.83 -5.67 17.41 Favored 'Trans proline' 0 C--N 1.343 0.25 0 C-N-CA 122.321 2.014 . . . . 0.0 112.687 179.921 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 67.7 m-80 -124.82 22.12 8.19 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.685 -0.234 . . . . 0.0 111.379 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 133.68 -167.76 23.46 Favored Glycine 0 C--N 1.33 0.212 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.784 179.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.675 HG13 ' O ' ' A' ' 53' ' ' ILE . 14.1 t -137.24 144.7 31.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 120.665 0.269 . . . . 0.0 111.008 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.567 HD22 ' HG ' ' A' ' 84' ' ' LEU . 3.7 mp -119.34 152.4 36.82 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.108 -179.97 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.435 ' O ' ' NE2' ' A' ' 83' ' ' GLN . 9.3 p -143.0 145.36 22.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.866 179.7 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -152.01 156.82 40.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.054 0.454 . . . . 0.0 111.814 -179.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . 0.438 ' HA ' HD12 ' A' ' 76' ' ' LEU . 4.0 m -145.04 156.05 43.71 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.858 -179.155 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.606 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -150.15 105.38 0.29 Allowed Glycine 0 CA--C 1.519 0.324 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.445 179.355 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.519 ' CB ' HG22 ' A' ' 48' ' ' VAL . 2.1 mtpp -108.68 45.9 1.0 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.57 0.581 . . . . 0.0 112.57 -178.618 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.605 ' ND1' HG21 ' A' ' 71' ' ' THR . 12.8 t-80 -76.73 156.52 32.4 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.795 0.331 . . . . 0.0 110.28 178.547 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.452 ' HA ' ' HA3' ' A' ' 46' ' ' GLY . 2.0 pt-20 -61.89 -26.98 68.48 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.798 0.333 . . . . 0.0 111.3 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -97.68 123.12 41.47 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.106 0.479 . . . . 0.0 111.564 -179.313 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 26.0 ttt -48.35 -49.14 35.51 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.693 179.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 -66.32 -38.78 88.47 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.466 -179.211 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.605 HG21 ' ND1' ' A' ' 66' ' ' HIS . 84.7 m -64.53 -41.51 96.33 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.719 -179.889 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.606 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -61.78 -48.7 79.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.646 179.599 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 25.4 mt -60.34 -46.85 94.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 120.891 0.377 . . . . 0.0 110.564 179.647 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -64.16 -39.2 93.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.615 179.558 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -65.46 -47.4 76.27 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.363 179.533 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.467 HD11 ' N ' ' A' ' 51' ' ' ALA . 0.5 OUTLIER -50.75 -57.82 7.42 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 179.204 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.54 HD13 HD12 ' A' ' 80' ' ' LEU . 22.9 mm -56.04 -32.16 32.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 178.482 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -59.94 -27.83 67.12 Favored 'General case' 0 N--CA 1.442 -0.839 0 CA-C-O 121.099 0.476 . . . . 0.0 110.596 178.487 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.99 -26.87 23.57 Favored 'General case' 0 CA--C 1.521 -0.135 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.219 179.27 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.729 ' O ' HD12 ' A' ' 84' ' ' LEU . 57.0 mt -62.87 -51.03 68.57 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 108.004 -1.109 . . . . 0.0 108.004 177.6 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -61.2 -44.83 96.65 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 114.567 -1.197 . . . . 0.0 110.778 177.841 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.51 -38.78 91.26 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.005 -179.356 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.435 ' NE2' ' O ' ' A' ' 61' ' ' VAL . 42.5 mt-30 -74.23 -39.15 63.27 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.874 0.369 . . . . 0.0 110.738 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.729 HD12 ' O ' ' A' ' 80' ' ' LEU . 2.9 mt -64.96 -26.88 68.49 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.814 179.599 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 39.6 t30 -62.3 -38.15 88.28 Favored 'General case' 0 CA--C 1.523 -0.09 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.315 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 19.7 mttt . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.975 179.958 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . 0.471 ' SD ' HD12 ' A' ' 23' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.863 0.364 . . . . 0.0 110.921 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 31.5 t-20 -121.89 119.06 30.49 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.42 -179.52 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 36.4 mt -118.27 123.73 72.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.476 179.363 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -134.67 160.44 38.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.97 0.414 . . . . 0.0 111.281 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 21.6 p -163.92 142.42 7.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.584 -179.67 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 10.6 mttt -100.9 28.49 5.2 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.892 -179.809 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 3.5 tp-100 -141.25 -46.08 0.38 Allowed 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.622 179.692 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 5.4 mpp? -114.0 -176.81 2.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.683 179.764 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -120.52 169.74 10.05 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.518 179.819 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.714 ' CD1' ' N ' ' A' ' 11' ' ' ILE . 0.3 OUTLIER -88.44 101.69 12.01 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.012 0 CA-C-O 121.547 0.689 . . . . 0.0 110.623 -178.474 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 17.6 p -95.55 151.1 38.32 Favored Pre-proline 0 C--N 1.322 -0.606 0 CA-C-N 114.695 -1.139 . . . . 0.0 110.877 179.735 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -54.78 -26.64 48.52 Favored 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 122.438 2.092 . . . . 0.0 111.803 179.182 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -74.48 -44.48 51.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.578 179.406 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.651 ' O ' HG23 ' A' ' 19' ' ' VAL . 21.3 mt -72.18 -27.78 27.66 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.326 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 178.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.5 -44.94 33.13 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.549 -0.751 . . . . 0.0 109.728 178.772 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 43.9 tt0 -67.67 -40.46 84.44 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.762 179.114 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.527 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 77.8 t60 -60.62 -58.02 10.23 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 179.167 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.651 HG23 ' O ' ' A' ' 15' ' ' ILE . 25.2 t -60.7 -47.87 91.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.693 0.282 . . . . 0.0 110.32 178.704 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.717 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -59.04 -40.6 85.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.226 -0.443 . . . . 0.0 112.039 179.662 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.527 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 0.9 OUTLIER -59.7 -35.1 73.82 Favored 'General case' 0 C--N 1.332 -0.166 0 C-N-CA 120.512 -0.475 . . . . 0.0 109.887 179.737 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.615 ' O ' HD12 ' A' ' 26' ' ' LEU . 5.6 mmm180 -76.53 -27.36 55.94 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.658 179.567 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.717 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 3.5 mt -68.54 -58.21 4.63 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.083 0.468 . . . . 0.0 110.529 179.687 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.65 -23.73 65.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.314 179.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 6.8 tmtt? -79.42 -29.79 42.05 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.132 0.491 . . . . 0.0 110.462 179.541 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.625 HD11 HG21 ' A' ' 77' ' ' ILE . 6.9 mt . . . . . 0 C--N 1.328 -0.354 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.077 -179.802 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.513 ' HB3' HG23 ' A' ' 53' ' ' ILE . 95.3 Cg_endo . . . . . 0 N--CA 1.463 -0.319 0 CA-C-O 120.82 0.259 . . . . 0.0 111.524 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . 0.504 ' C ' HD12 ' A' ' 38' ' ' ILE . 1.7 t-160 -107.43 129.79 54.89 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.07 0.462 . . . . 0.0 111.778 -179.261 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.642 ' N ' HD12 ' A' ' 38' ' ' ILE . 3.4 mp -121.09 133.17 68.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.526 179.45 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 5.2 mt -118.89 149.2 21.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.228 -179.78 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 8.9 mt -124.93 126.86 46.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.89 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 34.6 m -123.49 -173.83 2.82 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.507 179.739 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.432 ' HG3' ' CD2' ' A' ' 47' ' ' PHE . 3.4 ttpt -160.48 139.05 10.22 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.306 0.574 . . . . 0.0 111.333 -179.644 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -130.76 156.56 79.71 Favored Pre-proline 0 C--N 1.323 -0.583 0 CA-C-N 115.129 -0.941 . . . . 0.0 109.281 179.146 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_exo -51.34 -24.55 16.11 Favored 'Trans proline' 0 C--O 1.232 0.187 0 C-N-CA 121.974 1.783 . . . . 0.0 112.481 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -89.07 -6.2 57.29 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.456 -0.793 . . . . 0.0 112.662 -179.242 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 149.16 -161.55 28.76 Favored Glycine 0 C--O 1.224 -0.48 0 C-N-CA 120.245 -0.979 . . . . 0.0 112.129 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.432 ' CD2' ' HG3' ' A' ' 42' ' ' LYS . 16.9 m-85 -110.36 154.59 23.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.523 0.678 . . . . 0.0 111.98 179.923 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.528 HG22 ' HG2' ' A' ' 65' ' ' LYS . 68.8 t -128.08 139.34 52.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 114.867 -1.06 . . . . 0.0 110.94 -179.266 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.437 ' O ' ' HA ' ' A' ' 63' ' ' SER . . . -131.27 124.51 30.65 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.761 179.715 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -118.96 147.98 43.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.743 0.306 . . . . 0.0 110.999 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.499 ' N ' HD11 ' A' ' 76' ' ' LEU . . . -144.29 141.42 29.79 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.558 179.886 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.1 m -135.79 130.3 33.83 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.014 179.4 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.638 ' O ' HG13 ' A' ' 59' ' ' VAL . 11.7 mt -130.54 134.19 62.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 120.825 0.345 . . . . 0.0 110.904 -179.54 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -104.24 133.49 49.07 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.68 179.623 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 6.3 p -134.29 135.25 23.7 Favored Pre-proline 0 C--N 1.326 -0.421 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.347 179.476 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_exo -45.87 -20.81 0.81 Allowed 'Trans proline' 0 CA--C 1.53 0.29 0 C-N-CA 122.381 2.054 . . . . 0.0 112.921 179.853 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -111.48 20.69 16.97 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 112.095 0.406 . . . . 0.0 112.095 -179.571 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 142.44 -174.71 23.25 Favored Glycine 0 C--N 1.332 0.342 0 C-N-CA 120.286 -0.959 . . . . 0.0 113.319 179.52 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.638 HG13 ' O ' ' A' ' 53' ' ' ILE . 21.2 t -143.85 139.62 25.35 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-O 120.789 0.328 . . . . 0.0 111.005 -179.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.5 mp -117.85 153.76 32.97 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.009 0.433 . . . . 0.0 111.612 -179.418 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 16.7 t -140.49 145.64 25.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.714 179.742 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -153.15 152.57 31.42 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.189 0.519 . . . . 0.0 111.841 -179.579 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . 0.483 ' HA ' HD12 ' A' ' 76' ' ' LEU . 0.1 OUTLIER -144.89 158.08 43.93 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.666 -179.437 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.615 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -151.55 105.28 0.28 Allowed Glycine 0 C--N 1.331 0.298 0 N-CA-C 111.497 -0.641 . . . . 0.0 111.497 179.341 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.528 ' HG2' HG22 ' A' ' 48' ' ' VAL . 0.3 OUTLIER -106.71 44.83 1.02 Allowed 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.281 0.474 . . . . 0.0 112.281 -178.834 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 16.5 t-80 -75.4 156.36 35.45 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.635 -0.257 . . . . 0.0 110.317 178.601 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -59.61 -28.62 67.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.489 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 9.0 t0 -97.98 119.6 36.9 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.972 0.415 . . . . 0.0 111.566 -179.292 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . 0.422 ' O ' HD12 ' A' ' 73' ' ' ILE . 3.7 ttt -47.86 -47.01 31.84 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.516 179.846 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 35.5 m-85 -66.45 -42.28 87.82 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.151 -179.521 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 56.7 m -65.33 -37.4 86.98 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.669 179.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.615 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -62.4 -50.6 70.88 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.747 179.588 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.483 HG21 HG22 ' A' ' 19' ' ' VAL . 6.7 mt -61.97 -41.3 90.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 179.412 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -64.44 -41.45 96.56 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.062 179.091 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -66.31 -39.43 89.31 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.496 179.367 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.733 HD23 HG13 ' A' ' 77' ' ' ILE . 0.4 OUTLIER -54.97 -63.73 1.06 Allowed 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 179.079 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.733 HG13 HD23 ' A' ' 76' ' ' LEU . 4.8 mt -54.64 -26.89 17.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 110.274 -0.269 . . . . 0.0 110.274 178.871 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.23 -40.22 85.21 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-O 121.48 0.657 . . . . 0.0 109.282 178.087 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 7.3 mmtm -73.94 -31.38 63.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 114.916 -1.038 . . . . 0.0 110.205 178.817 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.79 ' O ' HD12 ' A' ' 84' ' ' LEU . 84.7 mt -62.88 -47.38 83.57 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 107.817 -1.179 . . . . 0.0 107.817 177.593 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -60.73 -46.25 91.14 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 114.821 -1.082 . . . . 0.0 110.32 177.65 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.42 -31.24 72.34 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.741 -179.858 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 -74.81 -45.32 44.29 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.942 0.401 . . . . 0.0 110.436 179.684 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.79 HD12 ' O ' ' A' ' 80' ' ' LEU . 1.4 mt -65.28 -26.17 67.96 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.865 179.681 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -62.71 -31.94 72.95 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.055 0.455 . . . . 0.0 110.357 179.647 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.246 179.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . 0.405 ' HB3' ' CD1' ' A' ' 23' ' ' LEU . 0.1 OUTLIER . . . . . 0 CA--C 1.526 0.04 0 CA-C-O 120.826 0.346 . . . . 0.0 110.694 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -124.45 130.52 52.62 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.297 -179.666 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 39.6 mt -136.2 124.82 37.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.667 179.621 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -134.45 160.74 37.04 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.941 0.401 . . . . 0.0 111.255 -179.962 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.415 ' HB3' ' HB2' ' A' ' 40' ' ' LEU . 21.9 p -162.67 145.75 11.09 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.39 -179.474 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.47 30.05 4.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.404 -179.47 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -142.39 -53.87 0.42 Allowed 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.806 179.579 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 2.1 mpp? -109.23 -176.68 3.09 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.803 179.8 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -115.72 168.74 9.76 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.666 179.754 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.465 HG22 ' HG3' ' A' ' 16' ' ' ARG . 5.1 mm -90.5 114.01 27.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 121.043 0.449 . . . . 0.0 111.143 -179.385 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 13.6 p -99.8 157.72 33.4 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.911 179.632 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -61.7 -15.76 44.21 Favored 'Trans proline' 0 C--N 1.343 0.265 0 C-N-CA 122.482 2.121 . . . . 0.0 111.88 179.056 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -83.15 -41.06 18.94 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-O 121.019 0.438 . . . . 0.0 110.263 179.181 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.45 ' O ' HG23 ' A' ' 19' ' ' VAL . 42.2 mt -72.79 -29.09 28.73 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.285 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 178.801 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.465 ' HG3' HG22 ' A' ' 11' ' ' ILE . 75.9 mtt180 -73.45 -47.33 42.35 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.521 178.667 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -67.15 -38.46 85.54 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.89 179.149 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.491 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 75.5 t60 -59.53 -62.7 1.68 Allowed 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.872 -0.418 . . . . 0.0 109.872 179.17 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.715 HG13 HD11 ' A' ' 77' ' ' ILE . 22.6 t -60.82 -47.57 92.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.735 178.95 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.669 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -56.68 -44.84 81.85 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 111.855 0.317 . . . . 0.0 111.855 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.491 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 1.1 p30 -59.34 -32.97 70.58 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.044 0.449 . . . . 0.0 110.408 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 31.3 mmt180 -75.13 -28.85 60.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.859 179.793 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.681 HD21 HG12 ' A' ' 19' ' ' VAL . 3.5 mt -69.17 -54.43 14.91 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.96 0.41 . . . . 0.0 110.659 179.653 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.51 -25.93 62.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.103 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.3 -32.3 43.48 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.268 0.556 . . . . 0.0 109.875 178.965 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 31.6 mt . . . . . 0 C--N 1.33 -0.256 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.673 179.757 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.484 ' HB3' HG23 ' A' ' 53' ' ' ILE . 95.2 Cg_endo . . . . . 0 N--CA 1.462 -0.35 0 CA-C-O 120.835 0.264 . . . . 0.0 112.241 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 1.7 t-160 -136.68 128.77 29.59 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.918 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.59 ' N ' HD12 ' A' ' 38' ' ' ILE . 3.7 mp -120.61 137.52 54.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.2 179.949 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 4.3 mp -114.7 148.28 17.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.877 179.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.415 ' HB2' ' HB3' ' A' ' 6' ' ' SER . 10.0 mt -123.34 127.5 48.59 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.939 0.4 . . . . 0.0 111.018 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -125.06 -170.97 2.26 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.645 179.918 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.471 ' HA ' ' HA ' ' A' ' 47' ' ' PHE . 2.7 ttmm -171.35 145.12 2.09 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.202 0.525 . . . . 0.0 111.039 -179.855 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.46 ' N ' ' HG2' ' A' ' 42' ' ' LYS . 2.2 mm-40 -130.1 166.28 27.64 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.015 178.816 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . 0.429 ' HD2' ' HB3' ' A' ' 43' ' ' GLU . 80.1 Cg_exo -48.72 -19.84 2.38 Favored 'Trans proline' 0 N--CA 1.463 -0.28 0 C-N-CA 121.837 1.691 . . . . 0.0 112.622 -178.946 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -85.38 -77.21 0.3 Allowed 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.004 179.078 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . 0.463 ' HA3' ' HA ' ' A' ' 67' ' ' GLU . . . -142.37 -153.69 5.97 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.629 -179.409 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.471 ' HA ' ' HA ' ' A' ' 42' ' ' LYS . 21.6 m-85 -109.29 150.5 27.88 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-O 121.709 0.766 . . . . 0.0 112.583 -179.354 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.612 HG22 ' CG ' ' A' ' 65' ' ' LYS . 59.8 t -124.37 140.39 47.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 114.397 -1.274 . . . . 0.0 110.254 179.955 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -131.62 124.98 31.07 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.66 0.267 . . . . 0.0 110.812 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -119.13 148.26 43.26 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.443 179.679 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.564 ' N ' HD11 ' A' ' 76' ' ' LEU . . . -147.11 144.38 28.99 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.981 0.42 . . . . 0.0 112.063 179.84 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.0 m -136.75 129.29 30.26 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.704 179.163 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.669 ' O ' HG13 ' A' ' 59' ' ' VAL . 9.0 mt -131.13 140.93 47.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-O 121.053 0.454 . . . . 0.0 111.716 -179.23 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -100.6 140.86 34.27 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.891 179.321 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 5.9 p -133.8 156.41 79.42 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.002 179.448 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_exo -65.24 -11.04 28.21 Favored 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 122.244 1.962 . . . . 0.0 112.659 -179.572 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 53.3 m-80 -125.92 21.4 7.55 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 111.75 0.278 . . . . 0.0 111.75 -179.605 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 143.95 -166.73 26.97 Favored Glycine 0 C--N 1.331 0.297 0 C-N-CA 120.258 -0.972 . . . . 0.0 113.181 179.627 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.669 HG13 ' O ' ' A' ' 53' ' ' ILE . 16.6 t -140.13 143.63 29.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 120.68 0.276 . . . . 0.0 110.986 -179.921 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.525 HD23 ' HB2' ' A' ' 83' ' ' GLN . 6.5 mp -118.01 152.16 36.05 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.919 0.39 . . . . 0.0 111.447 -179.676 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 19.6 t -140.8 147.31 22.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.881 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.413 ' HB1' ' HB2' ' A' ' 79' ' ' LYS . . . -153.91 156.73 38.06 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.235 0.54 . . . . 0.0 111.637 -179.724 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . 0.408 ' HA ' HD12 ' A' ' 76' ' ' LEU . 26.5 p -144.4 158.22 43.86 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.738 -179.341 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.75 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -152.91 105.28 0.27 Allowed Glycine 0 C--N 1.334 0.418 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.731 179.638 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.612 ' CG ' HG22 ' A' ' 48' ' ' VAL . 3.0 mptt -107.1 44.93 1.02 Allowed 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -178.905 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.651 ' ND1' HG21 ' A' ' 71' ' ' THR . 12.6 t-80 -76.21 156.46 33.58 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.802 0.335 . . . . 0.0 110.233 178.596 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.463 ' HA ' ' HA3' ' A' ' 46' ' ' GLY . 5.0 mt-10 -61.38 -26.45 67.84 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.781 0.324 . . . . 0.0 111.132 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -98.32 122.13 41.12 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.034 0.445 . . . . 0.0 111.372 -179.48 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . 0.681 ' HE3' HD11 ' A' ' 73' ' ' ILE . 0.8 OUTLIER -47.93 -49.64 29.5 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.817 179.901 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 18.4 m-85 -65.96 -37.02 84.92 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.587 -179.158 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.651 HG21 ' ND1' ' A' ' 66' ' ' HIS . 97.9 m -64.59 -41.52 96.19 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.695 0.283 . . . . 0.0 110.559 -179.901 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.75 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -61.55 -47.66 84.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.522 179.514 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.681 HD11 ' HE3' ' A' ' 69' ' ' MET . 14.1 mt -60.93 -46.34 96.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.584 179.553 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -64.44 -40.73 96.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.55 179.624 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -65.73 -44.53 85.72 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.604 179.795 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.564 HD11 ' N ' ' A' ' 51' ' ' ALA . 0.3 OUTLIER -53.23 -59.39 4.62 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.368 179.402 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.715 HD11 HG13 ' A' ' 19' ' ' VAL . 44.3 mt -56.12 -29.88 28.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 N-CA-C 110.183 -0.303 . . . . 0.0 110.183 179.023 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -58.72 -38.2 77.83 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.446 0.641 . . . . 0.0 109.668 178.45 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.413 ' HB2' ' HB1' ' A' ' 62' ' ' ALA . 0.0 OUTLIER -73.77 -29.17 62.05 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.01 178.937 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.474 HD12 ' HA ' ' A' ' 77' ' ' ILE . 94.8 mt -62.06 -48.81 78.57 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 107.759 -1.2 . . . . 0.0 107.759 177.379 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 11.9 tt0 -62.68 -44.34 96.51 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 114.514 -1.221 . . . . 0.0 110.481 177.76 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.68 -32.13 73.15 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.028 -179.367 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.525 ' HB2' HD23 ' A' ' 60' ' ' LEU . 25.0 mt-30 -74.91 -41.75 59.11 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.123 0.487 . . . . 0.0 110.38 179.788 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.11 -32.15 73.71 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.772 179.682 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 55.9 t30 -61.37 -33.6 73.91 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.549 -178.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 21.6 mttm . . . . . 0 C--N 1.326 -0.447 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.335 -179.753 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . 0.654 ' HG3' HD11 ' A' ' 23' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.528 0.11 0 CA-C-O 120.709 0.29 . . . . 0.0 110.858 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -122.11 120.67 34.94 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.879 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.469 HG23 ' O ' ' A' ' 4' ' ' ILE . 12.5 tt -125.58 124.42 66.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.731 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 3.0 p -134.51 163.73 29.05 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.832 0.348 . . . . 0.0 111.247 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 42.3 p -163.3 131.43 3.72 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.348 -179.5 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 11.7 mttt -100.7 42.39 1.12 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.914 -179.718 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -140.06 -46.14 0.43 Allowed 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.505 179.572 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 10.0 mtm -134.67 -178.87 5.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.468 179.664 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -89.93 164.35 14.6 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.673 179.863 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.0 mm -90.79 116.95 33.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.936 0.398 . . . . 0.0 110.859 -179.669 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 16.0 p -100.6 146.6 32.33 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.091 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_exo -55.33 -21.22 28.36 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.36 2.04 . . . . 0.0 111.652 179.12 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -74.72 -42.33 58.53 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 121.197 0.522 . . . . 0.0 110.287 179.331 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 38.8 mt -72.31 -30.42 35.21 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.305 178.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.438 ' O ' ' CB ' ' A' ' 20' ' ' ALA . 7.9 mtt180 -73.2 -46.41 50.6 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.602 178.666 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 47.5 tt0 -66.79 -37.0 83.7 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.641 179.106 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.479 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 50.2 t60 -59.88 -65.28 0.7 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.854 0.359 . . . . 0.0 110.067 179.014 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.646 HG12 HD21 ' A' ' 23' ' ' LEU . 21.6 t -60.18 -46.5 94.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.97 179.168 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.645 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -57.26 -45.34 84.09 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 179.95 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.479 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 1.5 p30 -59.46 -31.56 69.43 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 120.809 -0.356 . . . . 0.0 110.64 -179.857 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 16.6 mmt180 -74.75 -28.6 60.83 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.81 179.726 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.654 HD11 ' HG3' ' A' ' 2' ' ' MET . 1.6 mt -68.32 -51.61 42.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.935 0.398 . . . . 0.0 110.362 179.326 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.29 -24.13 63.02 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.823 179.592 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 7.0 tptp -77.43 -34.05 54.73 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.29 179.339 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.468 HD11 HG22 ' A' ' 77' ' ' ILE . 0.5 OUTLIER . . . . . 0 C--N 1.33 -0.259 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.715 179.37 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.513 ' HB3' HG23 ' A' ' 53' ' ' ILE . 94.8 Cg_endo . . . . . 0 N--CA 1.459 -0.532 0 N-CA-C 111.132 -0.372 . . . . 0.0 111.132 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . 0.453 ' C ' HD12 ' A' ' 38' ' ' ILE . 0.7 OUTLIER -105.07 127.36 52.85 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.065 0.46 . . . . 0.0 111.959 -179.01 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.635 ' N ' HD12 ' A' ' 38' ' ' ILE . 3.3 mp -120.16 134.09 64.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.062 179.168 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 39.1 mt -116.27 148.42 19.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.42 -179.635 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.2 mt -123.79 127.53 48.22 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.713 179.72 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -125.54 -170.52 2.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.712 -179.916 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.486 ' HA ' ' HA ' ' A' ' 47' ' ' PHE . 0.0 OUTLIER -171.56 145.43 2.04 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.243 0.544 . . . . 0.0 110.943 -179.833 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.449 ' HB3' ' HD2' ' A' ' 44' ' ' PRO . 2.8 mm-40 -130.38 164.9 38.01 Favored Pre-proline 0 C--N 1.323 -0.581 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.197 179.099 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . 0.449 ' HD2' ' HB3' ' A' ' 43' ' ' GLU . 3.2 Cg_endo -46.79 -21.82 1.64 Allowed 'Trans proline' 0 N--CA 1.462 -0.355 0 C-N-CA 122.239 1.959 . . . . 0.0 112.363 -179.282 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 45.5 tp60 -84.27 -78.6 0.23 Allowed 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.769 179.105 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . 0.439 ' HA3' ' HA ' ' A' ' 67' ' ' GLU . . . -141.07 -152.72 5.8 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.671 -179.288 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.486 ' HA ' ' HA ' ' A' ' 42' ' ' LYS . 19.6 m-85 -110.37 151.06 27.91 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.731 0.777 . . . . 0.0 112.819 -179.249 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.556 HG22 ' HG2' ' A' ' 65' ' ' LYS . 67.0 t -123.89 140.54 47.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 114.393 -1.276 . . . . 0.0 110.251 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.423 ' O ' ' HA ' ' A' ' 63' ' ' SER . . . -132.18 124.83 29.8 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.642 0.258 . . . . 0.0 111.003 -179.853 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -117.19 147.96 42.03 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.287 179.629 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.661 ' N ' HD11 ' A' ' 76' ' ' LEU . . . -144.97 142.74 30.08 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.998 0.428 . . . . 0.0 111.852 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.0 m -135.02 130.18 35.27 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.848 179.324 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.668 ' O ' HG13 ' A' ' 59' ' ' VAL . 16.1 mt -130.52 137.22 56.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.06 0.457 . . . . 0.0 111.464 -179.352 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -101.94 137.19 40.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.749 179.549 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 6.3 p -132.5 161.2 64.68 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.302 179.576 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_exo -68.12 -9.31 25.37 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.43 2.087 . . . . 0.0 112.582 -179.559 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -117.23 -3.71 11.46 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 111.744 0.275 . . . . 0.0 111.744 -179.773 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 158.33 -166.29 34.15 Favored Glycine 0 C--N 1.331 0.304 0 C-N-CA 120.366 -0.921 . . . . 0.0 112.754 179.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.668 HG13 ' O ' ' A' ' 53' ' ' ILE . 21.2 t -134.02 140.87 45.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 120.845 0.355 . . . . 0.0 111.161 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 11.0 mt -115.54 156.91 24.88 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.027 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.412 ' O ' ' NE2' ' A' ' 83' ' ' GLN . 21.1 t -140.31 149.69 21.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.008 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.418 ' O ' HD12 ' A' ' 76' ' ' LEU . . . -154.5 155.56 35.09 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.19 0.519 . . . . 0.0 111.544 -179.799 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . 0.423 ' HA ' ' O ' ' A' ' 49' ' ' ALA . 0.5 OUTLIER -145.45 158.08 43.9 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.759 -179.277 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.43 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -151.88 109.19 0.41 Allowed Glycine 0 C--N 1.331 0.257 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.628 179.505 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.556 ' HG2' HG22 ' A' ' 48' ' ' VAL . 1.0 OUTLIER -109.24 45.02 1.09 Allowed 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -178.861 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 13.0 t-80 -76.22 156.01 33.95 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.784 0.325 . . . . 0.0 110.367 178.651 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.439 ' HA ' ' HA3' ' A' ' 46' ' ' GLY . 0.3 OUTLIER -61.53 -27.52 68.67 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.723 0.297 . . . . 0.0 111.36 -179.84 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -98.2 121.47 40.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.012 0.434 . . . . 0.0 111.508 -179.39 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -47.95 -50.42 27.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.813 179.865 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 43.0 m-85 -66.85 -44.14 81.79 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.775 -179.016 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 16.8 m -63.96 -42.03 97.39 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.801 0.334 . . . . 0.0 110.883 -179.701 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.43 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -61.5 -47.99 83.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.715 179.611 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.621 HG21 HG22 ' A' ' 19' ' ' VAL . 16.4 mt -58.67 -44.28 89.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.96 0.41 . . . . 0.0 110.44 179.636 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -63.41 -36.11 82.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.362 179.373 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -64.85 -41.67 95.51 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.156 -0.475 . . . . 0.0 109.856 179.182 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.661 HD11 ' N ' ' A' ' 51' ' ' ALA . 0.2 OUTLIER -54.87 -59.9 4.1 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 178.878 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.65 HG13 HD23 ' A' ' 76' ' ' LEU . 6.9 mt -56.25 -30.48 30.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 110.013 -0.365 . . . . 0.0 110.013 178.727 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -59.85 -31.74 70.04 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-O 121.304 0.573 . . . . 0.0 110.157 178.196 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 7.2 mmtt -82.85 -24.87 33.06 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.485 179.162 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.574 HD13 HD11 ' A' ' 53' ' ' ILE . 93.4 mt -64.3 -47.63 78.71 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 107.574 -1.269 . . . . 0.0 107.574 177.111 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.575 ' O ' HD12 ' A' ' 84' ' ' LEU . 3.4 tt0 -59.31 -44.69 92.52 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 114.619 -1.173 . . . . 0.0 110.815 177.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -69.25 -37.08 77.76 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.706 -179.591 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.412 ' NE2' ' O ' ' A' ' 61' ' ' VAL . 36.6 mt-30 -78.19 -48.55 15.61 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 -178.665 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.967 HD13 ' N ' ' A' ' 85' ' ' ASN . 0.0 OUTLIER -63.7 -14.8 55.54 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 120.672 -0.411 . . . . 0.0 111.082 -179.402 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . 0.967 ' N ' HD13 ' A' ' 84' ' ' LEU . 0.2 OUTLIER -67.73 -28.23 67.47 Favored 'General case' 0 N--CA 1.457 -0.099 0 CA-C-O 121.152 0.501 . . . . 0.0 110.1 178.762 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 4.0 mmtm . . . . . 0 C--N 1.331 -0.221 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.323 -179.757 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . 0.588 ' CE ' ' HB2' ' A' ' 20' ' ' ALA . 1.2 ptt? . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.801 0.334 . . . . 0.0 110.867 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -121.95 128.55 51.63 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.107 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 36.9 mt -129.13 124.31 60.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.718 179.663 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -135.63 161.01 36.73 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.042 0.449 . . . . 0.0 111.397 -179.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 21.6 p -163.67 141.02 7.25 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.325 -179.682 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -100.36 27.74 5.5 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.183 -179.396 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -142.38 -45.34 0.33 Allowed 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.791 179.625 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 5.0 mpp? -113.23 -176.23 2.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.66 179.764 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -118.85 165.63 13.8 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.503 179.705 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 5.7 mm -89.73 109.3 20.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 121.149 0.499 . . . . 0.0 111.101 -179.413 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 16.1 p -98.19 159.09 31.54 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 115.428 -0.806 . . . . 0.0 110.986 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.431 ' HA ' ' HG2' ' A' ' 16' ' ' ARG . 23.6 Cg_exo -62.54 -13.5 33.84 Favored 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 122.579 2.186 . . . . 0.0 111.919 179.006 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -86.59 -41.93 13.89 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.959 0.409 . . . . 0.0 110.597 179.483 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 25.5 mt -71.93 -31.52 40.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.844 -0.616 . . . . 0.0 109.587 179.44 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.449 ' O ' ' HE1' ' A' ' 2' ' ' MET . 26.6 ptt180 -72.93 -44.24 61.43 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.485 178.796 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.401 ' N ' ' CG ' ' A' ' 16' ' ' ARG . 1.9 tm0? -65.62 -38.7 90.19 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.635 179.078 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.581 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 78.2 t60 -60.36 -50.05 75.16 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.48 -0.488 . . . . 0.0 109.685 178.787 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.704 ' O ' ' HG3' ' A' ' 22' ' ' ARG . 79.7 t -63.64 -44.01 98.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 177.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.684 ' HA ' ' HB2' ' A' ' 23' ' ' LEU . . . -63.24 -37.06 85.76 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.907 -0.317 . . . . 0.0 111.783 179.915 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.581 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 0.8 OUTLIER -60.3 -44.03 95.79 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 -179.611 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.784 ' HD3' HG21 ' A' ' 77' ' ' ILE . 1.6 ppt_? -74.75 -16.63 60.72 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.728 0.775 . . . . 0.0 109.01 178.372 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.684 ' HB2' ' HA ' ' A' ' 20' ' ' ALA . 0.2 OUTLIER -70.2 -63.78 1.02 Allowed 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 114.387 -1.279 . . . . 0.0 109.918 178.858 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.01 -21.14 65.94 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.185 179.338 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.12 -29.81 38.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.993 0.425 . . . . 0.0 110.935 179.789 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.627 HD12 ' HD2' ' A' ' 22' ' ' ARG . 9.1 mt . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.028 -179.582 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo . . . . . 0 N--CA 1.463 -0.298 0 N-CA-C 111.433 -0.257 . . . . 0.0 111.433 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -134.26 133.25 40.6 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.202 0.525 . . . . 0.0 111.907 -179.14 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.443 ' CD1' ' HB1' ' A' ' 51' ' ' ALA . 13.9 mm -121.47 132.21 71.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.64 179.531 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 37.9 mt -119.69 146.74 23.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.98 -179.883 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.647 HD22 HD11 ' A' ' 73' ' ' ILE . 2.2 mt -124.35 126.36 45.87 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.013 0.435 . . . . 0.0 110.842 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -123.02 -173.17 2.65 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.421 179.615 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.412 ' HA ' ' HA ' ' A' ' 47' ' ' PHE . 81.9 tttt -163.55 139.28 6.6 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.386 0.612 . . . . 0.0 111.285 -179.764 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -130.85 158.79 73.95 Favored Pre-proline 0 C--N 1.323 -0.554 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.382 179.137 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_exo -52.05 -24.31 19.4 Favored 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 121.957 1.772 . . . . 0.0 112.489 179.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.26 -6.03 57.12 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.506 -0.77 . . . . 0.0 112.689 -179.107 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 148.86 -161.02 28.59 Favored Glycine 0 C--O 1.223 -0.542 0 C-N-CA 120.299 -0.953 . . . . 0.0 112.159 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.423 ' CD1' ' N ' ' A' ' 47' ' ' PHE . 18.0 m-85 -111.35 155.11 23.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.516 0.674 . . . . 0.0 111.989 -179.908 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.781 HG22 ' CG ' ' A' ' 65' ' ' LYS . 94.0 t -127.41 139.44 51.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 114.844 -1.071 . . . . 0.0 111.01 -179.24 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.408 ' O ' ' HA ' ' A' ' 63' ' ' SER . . . -130.65 122.41 27.33 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.447 179.4 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -119.61 147.04 44.98 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.808 0.337 . . . . 0.0 111.115 -179.616 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.637 ' N ' HD11 ' A' ' 76' ' ' LEU . . . -143.56 139.43 29.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.207 179.719 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.0 m -135.95 130.54 33.84 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.294 179.674 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.676 ' O ' HG13 ' A' ' 59' ' ' VAL . 23.4 mt -132.38 134.89 58.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 120.873 0.368 . . . . 0.0 111.215 -179.753 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 9.3 m120 -103.02 119.41 38.8 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.978 179.625 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 33.3 p -112.44 157.09 41.11 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.406 179.541 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -63.3 -14.25 40.89 Favored 'Trans proline' 0 C--N 1.342 0.227 0 C-N-CA 122.521 2.148 . . . . 0.0 112.643 -179.77 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 59.6 m-80 -117.77 24.17 11.23 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.463 -179.707 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 134.93 -167.58 23.98 Favored Glycine 0 C--N 1.331 0.262 0 C-N-CA 120.48 -0.867 . . . . 0.0 112.815 179.797 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.676 HG13 ' O ' ' A' ' 53' ' ' ILE . 14.1 t -138.92 142.47 34.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 120.703 0.287 . . . . 0.0 110.956 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 16.3 mt -116.5 151.21 36.56 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.033 -179.79 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 15.0 p -139.47 148.18 23.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.086 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.536 ' O ' HD12 ' A' ' 76' ' ' LEU . . . -154.5 149.59 26.9 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.132 0.491 . . . . 0.0 111.559 -179.721 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . 0.408 ' HA ' ' O ' ' A' ' 49' ' ' ALA . 6.3 m -143.99 158.26 43.82 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.662 -179.437 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.658 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -150.48 105.34 0.29 Allowed Glycine 0 C--N 1.332 0.359 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.659 179.456 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.781 ' CG ' HG22 ' A' ' 48' ' ' VAL . 0.2 OUTLIER -103.75 45.04 0.98 Allowed 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.14 0.422 . . . . 0.0 112.14 -178.904 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.461 ' CE1' HG21 ' A' ' 71' ' ' THR . 12.5 t-80 -76.27 155.93 33.91 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.62 -0.264 . . . . 0.0 110.437 178.846 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -60.31 -28.0 67.77 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.587 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 7.2 t0 -98.29 120.13 38.17 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.957 0.408 . . . . 0.0 111.526 -179.308 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 24.2 ttt -48.05 -47.24 33.83 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.608 179.86 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -66.28 -41.21 90.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.101 -179.584 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.461 HG21 ' CE1' ' A' ' 66' ' ' HIS . 76.8 m -65.22 -37.22 86.6 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.416 -0.357 . . . . 0.0 110.613 179.779 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.658 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -63.08 -50.77 69.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.689 179.626 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.647 HD11 HD22 ' A' ' 40' ' ' LEU . 7.8 mt -62.08 -41.98 93.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 179.262 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -63.86 -39.86 95.2 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 178.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.439 ' HA ' ' HB3' ' A' ' 78' ' ' ASN . 5.3 mt-10 -66.88 -41.11 87.8 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.39 179.207 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.637 HD11 ' N ' ' A' ' 51' ' ' ALA . 0.2 OUTLIER -53.2 -61.65 2.16 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 178.838 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.784 HG21 ' HD3' ' A' ' 22' ' ' ARG . 52.2 mt -54.96 -30.27 23.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 178.502 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.439 ' HB3' ' HA ' ' A' ' 75' ' ' GLU . 0.0 OUTLIER -57.77 -38.48 75.51 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.065 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.14 -30.92 55.31 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 114.704 -1.135 . . . . 0.0 109.839 178.592 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.799 ' O ' HD12 ' A' ' 84' ' ' LEU . 67.7 mt -64.74 -49.15 71.94 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 107.987 -1.116 . . . . 0.0 107.987 177.608 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -59.71 -48.73 80.52 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.151 177.633 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 50.5 mtt-85 -64.3 -25.57 68.11 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.962 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -74.63 -48.57 25.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.354 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.799 HD12 ' O ' ' A' ' 80' ' ' LEU . 1.0 OUTLIER -64.5 -29.16 70.2 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.497 179.64 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 31.1 t-20 -61.54 -33.29 73.58 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.024 -0.535 . . . . 0.0 109.912 179.719 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.362 179.423 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' MET . . . . . 0.512 ' HG2' ' O ' ' A' ' 2' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.464 0.252 0 CA-C-O 121.444 0.64 . . . . 0.0 111.985 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -120.02 97.58 5.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.276 -179.58 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.565 ' CG2' HD11 ' A' ' 40' ' ' LEU . 34.3 mt -97.04 124.89 50.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.645 179.455 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -134.44 159.9 39.64 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.953 0.406 . . . . 0.0 111.239 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.609 ' HB3' HD12 ' A' ' 40' ' ' LEU . 21.8 p -163.42 145.29 9.65 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.475 -179.766 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 20.8 mmtp -103.41 -6.04 22.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.576 -179.663 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -99.97 -28.21 13.19 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 120.747 0.308 . . . . 0.0 111.209 -179.848 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 37.9 mtm -140.14 -175.52 4.27 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.071 -179.874 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 -111.06 166.93 10.65 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.653 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 5.2 mm -89.97 108.98 20.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 121.101 0.477 . . . . 0.0 111.066 -179.567 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 17.1 p -97.53 154.66 37.88 Favored Pre-proline 0 C--N 1.326 -0.441 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.002 179.721 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_exo -59.54 -17.92 44.16 Favored 'Trans proline' 0 C--N 1.343 0.281 0 C-N-CA 122.466 2.111 . . . . 0.0 112.029 179.339 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.14 -43.48 17.72 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.883 0.373 . . . . 0.0 110.573 179.629 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.576 ' O ' HG23 ' A' ' 19' ' ' VAL . 27.8 mt -72.6 -27.5 25.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.577 179.086 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 17.4 ttm180 -75.6 -44.77 41.32 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.367 178.732 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -67.84 -39.18 83.87 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.698 179.031 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.523 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 78.2 t60 -60.34 -57.23 13.67 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.843 -0.428 . . . . 0.0 109.843 178.989 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . 0.625 HG22 HG21 ' A' ' 73' ' ' ILE . 35.7 t -61.52 -47.68 92.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 120.778 0.323 . . . . 0.0 110.146 178.477 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.713 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -57.98 -42.34 84.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.958 179.755 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.523 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 0.9 OUTLIER -59.54 -35.21 73.77 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.118 0.485 . . . . 0.0 110.053 179.96 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.639 ' O ' HD12 ' A' ' 26' ' ' LEU . 25.5 mmm180 -76.24 -26.64 56.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.541 179.415 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.713 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 4.1 mt -68.09 -56.48 8.69 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.01 0.434 . . . . 0.0 110.298 179.484 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.65 -23.58 64.89 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.366 179.736 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.2 tmtm? -78.31 -30.98 48.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.107 0.479 . . . . 0.0 110.344 179.459 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.776 HD11 HG21 ' A' ' 77' ' ' ILE . 4.8 mt . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.649 179.556 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.567 ' HB3' HG23 ' A' ' 53' ' ' ILE . 90.7 Cg_endo . . . . . 0 C--O 1.232 0.185 0 N-CA-C 113.394 0.498 . . . . 0.0 113.394 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . 0.532 ' C ' HD12 ' A' ' 38' ' ' ILE . 0.2 OUTLIER -140.45 126.83 19.98 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.109 179.854 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.678 ' N ' HD12 ' A' ' 38' ' ' ILE . 3.0 mp -118.88 136.54 55.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.393 179.587 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 4.9 mt -121.06 148.64 24.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.566 -179.336 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.609 HD12 ' HB3' ' A' ' 6' ' ' SER . 1.3 mt -124.24 126.8 46.71 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.624 -0.717 . . . . 0.0 110.643 179.583 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 2.8 m -123.93 -174.26 2.94 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.507 179.898 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.412 ' HG3' ' CD2' ' A' ' 47' ' ' PHE . 11.0 tttm -160.95 140.71 10.79 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.424 0.631 . . . . 0.0 111.396 -179.845 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 65.2 mt-10 -131.41 162.15 57.74 Favored Pre-proline 0 C--N 1.322 -0.596 0 CA-C-N 115.026 -0.988 . . . . 0.0 109.305 179.347 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_endo -56.43 -25.7 59.12 Favored 'Trans proline' 0 N--CA 1.464 -0.229 0 C-N-CA 121.967 1.778 . . . . 0.0 111.95 179.621 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.09 -7.81 56.41 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.121 -0.945 . . . . 0.0 112.796 -179.059 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 150.52 -163.81 29.67 Favored Glycine 0 C--O 1.224 -0.522 0 C-N-CA 120.229 -0.986 . . . . 0.0 112.245 179.869 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.412 ' CD2' ' HG3' ' A' ' 42' ' ' LYS . 18.0 m-85 -108.87 154.85 21.54 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.499 0.666 . . . . 0.0 111.796 179.953 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.581 HG22 ' HG2' ' A' ' 65' ' ' LYS . 53.1 t -128.69 139.39 52.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 114.927 -1.033 . . . . 0.0 111.145 -179.27 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -130.42 123.91 30.89 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.525 179.441 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 28.7 m-20 -118.67 146.25 44.84 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.65 -0.25 . . . . 0.0 110.727 -179.845 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.609 ' CB ' HD11 ' A' ' 76' ' ' LEU . . . -145.66 140.64 27.45 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.724 -0.39 . . . . 0.0 111.484 179.8 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.407 HG23 HG22 ' A' ' 61' ' ' VAL . 3.0 m -134.59 128.96 34.23 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 179.102 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.567 HG23 ' HB3' ' A' ' 36' ' ' PRO . 21.4 mt -133.75 139.34 48.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 C-N-CA 120.724 -0.391 . . . . 0.0 111.852 -179.277 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -99.86 145.38 27.83 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.85 179.116 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.416 ' HB ' ' HD2' ' A' ' 56' ' ' PRO . 18.9 p -138.76 158.85 69.35 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.502 179.261 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.416 ' HD2' ' HB ' ' A' ' 55' ' ' THR . 60.6 Cg_endo -73.96 -1.41 10.82 Favored 'Trans proline' 0 N--CA 1.463 -0.31 0 C-N-CA 121.772 1.648 . . . . 0.0 112.729 -179.243 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -126.5 2.39 6.91 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.567 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 162.31 -164.8 35.74 Favored Glycine 0 C--N 1.333 0.363 0 C-N-CA 120.405 -0.902 . . . . 0.0 112.925 -179.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 21.3 t -132.8 148.16 31.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.802 0.334 . . . . 0.0 111.083 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.417 HD11 HD21 ' A' ' 84' ' ' LEU . 14.1 mt -121.09 136.01 55.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.428 -179.672 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.407 HG22 HG23 ' A' ' 52' ' ' THR . 21.3 t -140.69 137.29 35.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.657 179.657 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.57 ' O ' HD12 ' A' ' 76' ' ' LEU . . . -153.09 155.86 37.6 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.279 0.561 . . . . 0.0 111.892 -179.418 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 88.8 p -143.98 157.41 44.35 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.252 -0.885 . . . . 0.0 111.682 -179.31 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.797 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -150.92 99.64 0.2 Allowed Glycine 0 C--N 1.332 0.323 0 CA-C-N 115.833 -0.622 . . . . 0.0 111.559 179.461 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.581 ' HG2' HG22 ' A' ' 48' ' ' VAL . 59.9 mttt -100.83 44.57 1.01 Allowed 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -178.966 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 12.4 t-80 -75.66 155.31 35.89 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.256 178.709 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -60.46 -26.81 67.06 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.685 0.278 . . . . 0.0 111.29 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -97.09 116.7 29.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.99 0.424 . . . . 0.0 111.329 -179.449 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.7 tmt? -47.57 -46.42 28.01 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.665 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 -66.48 -41.41 89.01 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.31 -179.534 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 35.4 m -65.41 -37.67 87.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.787 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.797 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -61.88 -51.54 67.77 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.822 179.782 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.625 HG21 HG22 ' A' ' 19' ' ' VAL . 7.7 mt -61.64 -42.5 94.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 120.84 0.352 . . . . 0.0 110.319 179.561 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -63.67 -40.2 96.24 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.109 179.253 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -66.47 -42.58 87.32 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.635 179.413 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.609 HD11 ' CB ' ' A' ' 51' ' ' ALA . 0.2 OUTLIER -52.55 -60.94 2.63 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 179.3 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.776 HG21 HD11 ' A' ' 26' ' ' LEU . 21.9 mt -56.66 -30.29 31.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 178.706 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -59.19 -29.06 67.2 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-O 121.272 0.558 . . . . 0.0 109.974 178.069 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.46 ' HB2' ' HB1' ' A' ' 62' ' ' ALA . 1.2 mptt -86.49 -29.32 22.84 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.384 179.184 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.695 ' O ' HD12 ' A' ' 84' ' ' LEU . 84.1 mt -63.14 -49.76 73.09 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 177.671 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -60.04 -46.44 89.51 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 114.926 -1.033 . . . . 0.0 110.416 177.759 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.51 -33.86 75.74 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.317 -179.506 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.427 HE22 ' HB2' ' A' ' 62' ' ' ALA . 37.0 mt-30 -74.73 -42.36 58.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.836 0.351 . . . . 0.0 110.451 179.765 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.695 HD12 ' O ' ' A' ' 80' ' ' LEU . 1.5 mt -65.05 -29.26 70.14 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.61 179.523 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -61.81 -49.26 77.05 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.133 0.492 . . . . 0.0 110.256 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.367 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.974 179.519 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 25.9 p . . . . . 0 N--CA 1.487 1.408 0 CA-C-O 120.766 0.317 . . . . 0.0 111.183 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . 0.698 ' HG3' HD11 ' A' ' 23' ' ' LEU . 8.2 ttp -170.36 102.9 0.27 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.826 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -119.52 122.97 42.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.078 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.421 ' CG2' HD11 ' A' ' 40' ' ' LEU . 36.9 mt -120.68 125.54 74.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.849 179.76 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -134.02 160.71 36.92 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.862 0.363 . . . . 0.0 111.119 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.41 ' HB3' ' HB2' ' A' ' 40' ' ' LEU . 44.8 p -163.43 142.67 8.34 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.637 -179.533 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -102.47 31.25 4.15 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.002 -179.571 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -140.95 -48.0 0.41 Allowed 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.647 179.623 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -119.32 -174.29 2.69 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.638 179.72 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -114.33 167.63 10.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.618 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 5.0 mm -91.2 115.56 30.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.109 0.481 . . . . 0.0 111.085 -179.502 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.419 ' H ' HD12 ' A' ' 15' ' ' ILE . 15.4 p -99.74 149.33 35.83 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.887 179.75 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_exo -56.39 -19.64 29.47 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.335 2.023 . . . . 0.0 111.919 179.216 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -77.75 -41.6 37.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.078 0.466 . . . . 0.0 110.284 179.234 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.428 ' O ' HG23 ' A' ' 19' ' ' VAL . 22.9 mt -73.23 -29.1 27.22 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.367 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.517 178.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 13.3 ttp85 -74.12 -45.74 47.02 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.604 -0.726 . . . . 0.0 109.227 178.722 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 33.8 tt0 -67.46 -37.35 82.8 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.503 178.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.494 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 72.5 t60 -59.2 -62.49 1.85 Allowed 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 178.872 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.89 HG13 HD11 ' A' ' 77' ' ' ILE . 22.2 t -60.65 -46.56 95.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.609 -0.268 . . . . 0.0 110.536 178.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.678 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -57.06 -43.94 82.53 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.846 179.746 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.494 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 1.1 p30 -59.66 -33.34 71.42 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.95 0.405 . . . . 0.0 110.645 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 10.3 mmt180 -74.67 -28.16 60.72 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.058 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.698 HD11 ' HG3' ' A' ' 2' ' ' MET . 2.4 mt -67.53 -52.77 34.94 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.151 0.5 . . . . 0.0 110.293 179.453 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.48 -25.45 66.06 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.217 179.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.94 -28.28 43.72 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.934 179.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.66 HD12 ' HA ' ' A' ' 23' ' ' LEU . 5.8 mt -76.73 59.68 1.59 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.0 -179.816 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.04 -52.49 16.7 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.859 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.416 ' HG3' ' N ' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -52.25 -26.1 11.02 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.473 0.654 . . . . 0.0 110.917 179.691 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.599 ' CD1' HD23 ' A' ' 26' ' ' LEU . 71.4 m95 -87.9 -25.63 23.15 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.943 -1.026 . . . . 0.0 111.794 -179.359 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.4 114.39 1.64 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.87 179.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.528 HG23 ' CD2' ' A' ' 32' ' ' HIS . 15.4 t -159.4 -39.69 0.06 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.331 -179.705 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . 0.528 ' CD2' HG23 ' A' ' 31' ' ' THR . 1.0 OUTLIER -143.41 -120.17 0.09 Allowed 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 116.748 -0.206 . . . . 0.0 110.892 179.556 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.971 HD23 HG21 ' A' ' 53' ' ' ILE . 1.9 mp 61.06 116.27 0.02 OUTLIER 'General case' 0 N--CA 1.46 0.071 0 CA-C-O 120.768 0.318 . . . . 0.0 110.542 -179.759 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.406 HD11 ' HG3' ' A' ' 56' ' ' PRO . 3.1 mt -127.06 104.48 12.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.813 0.34 . . . . 0.0 111.538 -179.581 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 61.26 74.46 0.51 Allowed Pre-proline 0 C--N 1.328 -0.349 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.432 179.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.825 ' HB3' HD12 ' A' ' 53' ' ' ILE . 77.0 Cg_endo -76.93 155.04 34.02 Favored 'Trans proline' 0 C--N 1.343 0.269 0 C-N-CA 122.63 2.22 . . . . 0.0 111.958 179.487 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -136.84 130.05 31.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.233 -179.66 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.64 ' N ' HD12 ' A' ' 38' ' ' ILE . 3.4 mp -121.46 134.6 64.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.855 179.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 4.1 mp -116.95 146.04 21.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.999 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.507 HD21 HG12 ' A' ' 73' ' ' ILE . 1.8 mt -122.31 128.32 50.91 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.054 0.454 . . . . 0.0 111.023 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 5.3 m -123.99 -173.55 2.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.301 179.6 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.425 ' HG3' ' CD2' ' A' ' 47' ' ' PHE . 3.0 tttp -158.58 141.29 14.46 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.372 0.606 . . . . 0.0 111.43 -179.678 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -131.82 156.37 80.2 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-N 115.075 -0.966 . . . . 0.0 109.146 179.232 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_exo -51.73 -24.42 17.92 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 121.881 1.721 . . . . 0.0 112.382 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.72 -6.84 55.66 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.47 -0.786 . . . . 0.0 112.808 -179.148 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 149.68 -164.15 29.44 Favored Glycine 0 C--O 1.224 -0.501 0 C-N-CA 120.153 -1.022 . . . . 0.0 112.161 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.425 ' CD2' ' HG3' ' A' ' 42' ' ' LYS . 18.0 m-85 -108.19 152.63 24.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.544 0.688 . . . . 0.0 112.015 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.695 HG22 ' HG2' ' A' ' 65' ' ' LYS . 53.2 t -127.55 142.01 44.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 114.753 -1.112 . . . . 0.0 110.96 -179.23 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -132.45 124.88 29.45 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.986 179.666 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -117.7 149.5 40.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.436 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.64 ' N ' HD11 ' A' ' 76' ' ' LEU . . . -146.02 142.06 28.26 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.905 0.383 . . . . 0.0 111.798 -179.728 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.728 ' O ' HD13 ' A' ' 53' ' ' ILE . 4.4 m -134.35 134.04 41.33 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.278 179.651 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.971 HG21 HD23 ' A' ' 33' ' ' LEU . 3.4 mm -132.54 133.29 59.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.979 0.418 . . . . 0.0 111.16 -179.69 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 13.5 m-20 -102.98 130.86 50.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.427 179.02 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.415 HG22 ' HA ' ' A' ' 33' ' ' LEU . 7.3 p -128.6 165.74 29.38 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.749 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.406 ' HG3' HD11 ' A' ' 34' ' ' ILE . 12.5 Cg_exo -69.87 -8.98 24.96 Favored 'Trans proline' 0 CA--C 1.529 0.247 0 C-N-CA 122.703 2.269 . . . . 0.0 112.55 -179.871 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -123.08 22.91 9.41 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 111.694 0.257 . . . . 0.0 111.694 -179.632 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 132.77 -167.42 23.23 Favored Glycine 0 C--N 1.331 0.255 0 C-N-CA 120.441 -0.885 . . . . 0.0 112.938 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.662 HG13 ' O ' ' A' ' 53' ' ' ILE . 14.9 t -136.43 143.48 35.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.813 0.339 . . . . 0.0 110.943 -179.853 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.754 HD21 HD11 ' A' ' 87' ' ' LEU . 1.9 mt -115.55 155.72 27.05 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.981 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 21.4 t -140.19 148.03 22.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.312 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.439 ' HB1' ' HB2' ' A' ' 79' ' ' LYS . . . -153.73 146.52 24.33 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.045 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -146.16 155.72 42.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.744 -179.442 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.462 ' O ' HG13 ' A' ' 48' ' ' VAL . . . -142.85 154.49 25.34 Favored Glycine 0 N--CA 1.452 -0.277 0 N-CA-C 111.181 -0.768 . . . . 0.0 111.181 179.128 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.695 ' HG2' HG22 ' A' ' 48' ' ' VAL . 19.6 mttt -147.59 42.92 1.08 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 117.239 0.519 . . . . 0.0 112.018 -179.336 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.629 ' ND1' HG21 ' A' ' 71' ' ' THR . 12.8 t-80 -76.06 154.96 35.25 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.303 178.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -60.96 -26.14 67.32 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.727 0.299 . . . . 0.0 111.165 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -98.5 121.94 41.07 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.044 0.45 . . . . 0.0 111.433 -179.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.9 ttt -48.33 -49.18 35.17 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.802 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 42.2 m-85 -65.75 -37.6 86.83 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.44 -179.242 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.629 HG21 ' ND1' ' A' ' 66' ' ' HIS . 93.6 m -64.85 -40.42 95.14 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.792 0.329 . . . . 0.0 110.613 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.82 -48.28 81.31 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.624 179.552 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.507 HG12 HD21 ' A' ' 40' ' ' LEU . 10.3 mt -60.52 -43.0 93.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.839 0.352 . . . . 0.0 110.181 179.384 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -65.21 -39.65 93.08 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.212 179.099 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -66.64 -45.61 78.46 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.728 179.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.64 HD11 ' N ' ' A' ' 51' ' ' ALA . 0.2 OUTLIER -53.42 -61.09 2.52 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.554 -0.294 . . . . 0.0 110.284 179.479 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.89 HD11 HG13 ' A' ' 19' ' ' VAL . 62.4 mt -55.37 -28.19 21.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 C-N-CA 120.899 -0.32 . . . . 0.0 110.201 179.086 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -58.99 -38.0 78.15 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 177.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.439 ' HB2' ' HB1' ' A' ' 62' ' ' ALA . 0.0 OUTLIER -73.25 -30.22 63.31 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 114.755 -1.112 . . . . 0.0 109.849 178.69 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 84.1 mt -63.31 -48.63 77.27 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 177.511 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.435 ' HG2' ' CZ2' ' A' ' 29' ' ' TRP . 6.4 tt0 -61.69 -49.44 76.46 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 114.625 -1.171 . . . . 0.0 110.52 177.801 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.07 -27.27 69.28 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.157 -179.77 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -75.38 -44.49 44.57 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.932 0.396 . . . . 0.0 110.686 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.704 ' HA ' HD12 ' A' ' 87' ' ' LEU . 3.5 mt -64.2 -26.46 68.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.71 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -63.6 -41.48 98.32 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.192 179.653 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 17.5 mmtt -74.21 -18.98 60.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.285 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.754 HD11 HD21 ' A' ' 60' ' ' LEU . 20.6 mt -67.99 -38.9 83.22 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.945 0.402 . . . . 0.0 110.443 179.842 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 -78.4 -21.1 49.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.842 179.458 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.408 ' CD2' ' O ' ' A' ' 87' ' ' LEU . 22.9 m-70 55.29 -162.64 0.15 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.019 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -168.71 -42.54 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.835 179.828 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 69.56 -175.31 33.83 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.621 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -109.03 -27.42 9.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.781 0.324 . . . . 0.0 110.972 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . 65.64 125.87 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.109 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -154.21 119.46 5.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.819 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -87.72 -79.43 0.29 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.96 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -179.14 -168.73 0.13 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.089 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -93.24 -31.11 14.86 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.061 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 1.6 m -125.1 -65.39 1.03 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.837 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . 0.514 ' O ' HG22 ' A' ' 100' ' ' VAL . 29.2 t -176.86 -43.88 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.866 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.514 HG22 ' O ' ' A' ' 99' ' ' SER . 24.2 m 45.63 -172.37 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.674 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -177.32 114.6 0.09 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.86 -179.848 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 29.9 m-20 -149.35 122.15 8.7 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.985 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -175.72 131.99 0.27 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.092 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -141.62 143.13 33.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.897 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 19.7 m-85 -109.64 -29.77 8.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.933 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 8.7 m -56.8 -31.38 35.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.204 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.4 tm-20 -144.1 87.53 1.9 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.837 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -166.31 35.6 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.889 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.445 HG23 ' N ' ' A' ' 110' ' ' GLU . 13.9 m -154.99 -46.08 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.083 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . 0.445 ' N ' HG23 ' A' ' 109' ' ' VAL . 4.2 tt0 -59.46 -57.95 10.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.863 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -90.92 -32.39 16.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.857 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 . . . . . 0 C--O 1.25 1.089 0 CA-C-O 118.201 -0.904 . . . . 0.0 110.944 179.977 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.486 1.336 0 CA-C-O 120.757 0.313 . . . . 0.0 111.168 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.7 tmt? 57.25 86.3 0.07 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.906 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.401 ' OD1' ' CE1' ' A' ' 37' ' ' HIS . 3.3 t-20 -127.76 109.38 11.59 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.278 -179.631 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.844 HG22 ' HB ' ' A' ' 38' ' ' ILE . 7.7 pt -118.19 128.66 75.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.702 179.561 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.551 ' HA ' HD11 ' A' ' 11' ' ' ILE . 2.9 p -134.0 165.85 24.07 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.229 -179.771 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.469 ' HB3' HD12 ' A' ' 40' ' ' LEU . 21.7 p -163.51 144.47 9.12 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.24 -179.787 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.77 -2.67 27.66 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.67 -179.54 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -98.85 -29.44 12.96 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 120.705 0.288 . . . . 0.0 111.041 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 34.6 mtm -143.41 178.79 7.51 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.032 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -98.74 163.88 12.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.69 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.632 HG22 ' HG3' ' A' ' 16' ' ' ARG . 5.0 mm -90.67 116.68 32.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.052 0.453 . . . . 0.0 111.05 -179.543 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 15.1 p -100.52 158.47 31.86 Favored Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.959 179.771 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_exo -63.32 -14.65 43.41 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.519 2.146 . . . . 0.0 111.911 179.091 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -84.49 -41.24 16.76 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-O 121.012 0.434 . . . . 0.0 110.434 179.507 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 34.6 mt -72.95 -30.5 32.44 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.299 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.284 178.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.674 ' HA ' HD11 ' A' ' 4' ' ' ILE . 47.3 mtp180 -71.67 -47.11 56.45 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.502 178.551 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 19.4 tt0 -67.18 -36.07 80.99 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.557 178.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.457 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 56.6 t60 -60.13 -64.56 0.91 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.951 0.405 . . . . 0.0 110.025 178.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.698 HG12 HD21 ' A' ' 23' ' ' LEU . 23.3 t -61.34 -47.1 95.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.9 179.128 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.66 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -56.44 -47.06 79.9 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 111.751 0.278 . . . . 0.0 111.751 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.457 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 3.2 p30 -59.83 -29.1 68.04 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.705 -0.398 . . . . 0.0 110.447 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 17.2 mmm180 -75.7 -29.85 59.12 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.591 179.41 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.698 HD21 HG12 ' A' ' 19' ' ' VAL . 1.3 mt -68.17 -50.62 53.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.942 0.401 . . . . 0.0 110.272 179.183 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.33 -24.32 63.25 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.803 179.467 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 29.4 tttt -78.1 -32.49 50.58 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.409 179.238 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.713 HD23 ' HE1' ' A' ' 29' ' ' TRP . 0.5 OUTLIER -80.69 56.11 2.56 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.757 179.542 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -111.66 -7.8 14.24 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.496 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.72 -13.74 61.7 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.803 0.335 . . . . 0.0 111.389 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.713 ' HE1' HD23 ' A' ' 26' ' ' LEU . 61.7 m95 -85.04 168.58 14.78 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.145 -179.73 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -96.07 -3.05 45.45 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.332 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.692 HG23 HD11 ' A' ' 33' ' ' LEU . 4.7 t -77.52 128.84 34.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.869 0.366 . . . . 0.0 110.526 179.55 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . 0.418 ' C ' HD12 ' A' ' 33' ' ' LEU . 64.5 m-70 -81.9 -39.93 23.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.967 -179.799 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 1.02 HD23 HG21 ' A' ' 53' ' ' ILE . 1.6 mp 62.44 135.5 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.276 -179.711 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.584 HG22 ' ND2' ' A' ' 35' ' ' ASN . 4.8 mt -127.56 106.65 15.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-O 121.403 0.621 . . . . 0.0 112.147 -179.235 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.584 ' ND2' HG22 ' A' ' 34' ' ' ILE . 34.1 m-80 53.87 75.61 0.61 Allowed Pre-proline 0 C--N 1.326 -0.431 0 CA-C-N 114.903 -1.044 . . . . 0.0 112.328 178.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.5 ' HB3' HG23 ' A' ' 53' ' ' ILE . 86.3 Cg_endo -79.3 154.43 24.78 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.684 2.256 . . . . 0.0 111.326 178.744 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . 0.401 ' CE1' ' OD1' ' A' ' 3' ' ' ASN . 1.6 t-160 -134.0 128.43 34.36 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.123 0.487 . . . . 0.0 111.612 -179.397 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.844 ' HB ' HG22 ' A' ' 4' ' ' ILE . 3.4 mp -120.73 135.63 60.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.594 179.491 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 26.5 mt -115.78 146.44 20.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.937 0.399 . . . . 0.0 111.254 -179.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.469 HD12 ' HB3' ' A' ' 6' ' ' SER . 2.9 mt -119.86 128.68 53.89 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.808 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 9.2 m -125.5 -170.46 2.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.733 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.487 ' HA ' ' HA ' ' A' ' 47' ' ' PHE . 3.6 ttpm? -173.29 145.96 1.35 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.186 0.517 . . . . 0.0 110.762 -179.812 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.443 ' HB3' ' HD2' ' A' ' 44' ' ' PRO . 5.5 mt-10 -131.0 170.47 11.15 Favored Pre-proline 0 C--N 1.324 -0.504 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.213 179.043 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . 0.443 ' HD2' ' HB3' ' A' ' 43' ' ' GLU . 69.0 Cg_exo -51.62 -19.34 7.31 Favored 'Trans proline' 0 N--CA 1.463 -0.282 0 C-N-CA 121.786 1.658 . . . . 0.0 112.354 -179.332 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.01 -78.71 0.27 Allowed 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.905 179.094 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . 0.404 ' HA3' ' HA ' ' A' ' 67' ' ' GLU . . . -141.16 -154.6 6.24 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.665 -179.281 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.487 ' HA ' ' HA ' ' A' ' 42' ' ' LYS . 20.1 m-85 -109.6 151.33 26.96 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 121.623 0.725 . . . . 0.0 112.726 -179.437 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.657 HG22 ' CG ' ' A' ' 65' ' ' LYS . 54.9 t -124.61 142.93 39.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 114.511 -1.222 . . . . 0.0 110.48 -179.888 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -132.9 126.08 31.33 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.238 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.419 ' O ' HG23 ' A' ' 38' ' ' ILE . 1.6 m-20 -118.92 150.28 40.17 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.583 179.713 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.645 ' HB2' HD21 ' A' ' 76' ' ' LEU . . . -146.8 141.14 26.37 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.845 0.355 . . . . 0.0 111.657 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.2 m -135.79 130.83 34.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.024 179.45 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 1.02 HG21 HD23 ' A' ' 33' ' ' LEU . 13.4 mt -133.02 138.03 52.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 121.102 0.477 . . . . 0.0 111.785 -179.69 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 19.9 m-20 -102.05 119.25 38.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.723 179.362 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 10.6 p -112.23 156.3 42.24 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.453 179.747 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -63.48 -14.21 41.02 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 122.484 2.123 . . . . 0.0 112.619 -179.776 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 9.1 m120 -119.69 23.4 11.16 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.628 -0.26 . . . . 0.0 111.538 -179.644 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 137.07 -166.95 24.82 Favored Glycine 0 N--CA 1.453 -0.175 0 C-N-CA 120.488 -0.863 . . . . 0.0 112.902 179.791 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.664 HG13 ' O ' ' A' ' 53' ' ' ILE . 15.0 t -135.91 142.91 37.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.828 0.347 . . . . 0.0 111.037 -179.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 37.0 mt -116.98 152.75 33.94 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.11 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 21.5 t -139.91 146.78 24.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.067 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.6 ' HB2' HE22 ' A' ' 83' ' ' GLN . . . -153.58 150.64 28.88 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.074 0.464 . . . . 0.0 111.205 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 94.3 p -145.69 156.17 43.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.73 -179.212 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.422 ' O ' ' HA ' ' A' ' 48' ' ' VAL . . . -144.39 146.91 17.83 Favored Glycine 0 C--N 1.331 0.302 0 N-CA-C 111.06 -0.816 . . . . 0.0 111.06 179.034 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.657 ' CG ' HG22 ' A' ' 48' ' ' VAL . 8.1 mttt -141.21 43.8 1.78 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 117.212 0.506 . . . . 0.0 112.056 -178.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.609 ' ND1' HG21 ' A' ' 71' ' ' THR . 12.9 t-80 -76.8 155.3 33.17 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.794 0.33 . . . . 0.0 110.436 178.887 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.404 ' HA ' ' HA3' ' A' ' 46' ' ' GLY . 21.2 mt-10 -61.13 -26.66 67.84 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.323 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -97.93 123.62 42.0 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.027 0.441 . . . . 0.0 111.45 -179.34 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.3 ttt -48.06 -50.15 29.0 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.774 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 72.6 m-85 -66.32 -38.29 87.35 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.672 -179.037 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.609 HG21 ' ND1' ' A' ' 66' ' ' HIS . 87.2 m -64.51 -42.57 95.73 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.698 0.285 . . . . 0.0 110.82 -179.775 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.09 -47.42 86.38 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.516 179.575 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.521 HG21 HG22 ' A' ' 19' ' ' VAL . 13.0 mt -60.13 -45.39 95.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 120.959 0.409 . . . . 0.0 110.311 179.459 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -64.62 -39.0 92.92 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.364 179.475 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -65.24 -43.59 90.9 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.412 179.46 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.645 HD21 ' HB2' ' A' ' 51' ' ' ALA . 0.2 OUTLIER -54.35 -57.34 11.64 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 179.065 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.577 HG13 HD23 ' A' ' 76' ' ' LEU . 8.7 mt -57.53 -30.58 36.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 N-CA-C 110.104 -0.332 . . . . 0.0 110.104 178.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -57.97 -37.78 74.82 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.561 0.696 . . . . 0.0 109.38 178.391 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -75.11 -28.9 60.41 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.708 -1.133 . . . . 0.0 109.935 178.873 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.483 HD12 ' HA ' ' A' ' 77' ' ' ILE . 99.3 mt -62.74 -49.45 74.98 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 177.424 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -62.29 -43.87 97.83 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 114.53 -1.214 . . . . 0.0 110.511 177.646 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 1.4 ptt180 -62.4 -34.61 77.07 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.638 -179.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.6 HE22 ' HB2' ' A' ' 62' ' ' ALA . 38.5 mt-30 -74.52 -39.22 62.51 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.478 179.57 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.491 ' CD2' HG21 ' A' ' 31' ' ' THR . 19.3 mt -65.78 -26.01 67.51 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.846 179.581 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -63.93 -42.39 97.36 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.583 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.457 ' HA ' ' CD2' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -73.92 -22.73 59.58 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.051 179.882 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.816 ' O ' HD23 ' A' ' 87' ' ' LEU . 4.2 tt -70.96 -14.37 62.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.955 -179.597 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.405 ' CG ' ' N ' ' A' ' 89' ' ' HIS . 2.1 pt20 -75.83 -47.34 26.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.067 0.46 . . . . 0.0 111.541 -179.278 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.457 ' CD2' ' HA ' ' A' ' 86' ' ' LYS . 6.6 p80 -87.26 -170.73 3.17 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.128 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.421 ' CB ' ' O ' ' A' ' 89' ' ' HIS . 0.6 OUTLIER 83.6 83.83 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.899 179.811 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 69.04 -169.81 42.19 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.528 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -146.99 125.97 12.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.767 0.318 . . . . 0.0 110.915 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -62.1 174.67 0.84 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.201 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 17.7 ttm-85 -150.26 -47.8 0.13 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.813 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.44 31.67 3.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.778 179.895 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -72.58 -31.08 64.93 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.228 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -62.79 169.22 3.31 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.184 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 34.2 p -87.82 141.67 28.41 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.929 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 66.5 m -109.93 175.42 5.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.909 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 27.1 m -104.04 -29.62 2.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.132 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.91 176.28 0.32 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.887 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 11.5 p30 -157.27 38.53 0.29 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.8 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.77 -19.79 65.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.359 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 22.8 p30 -53.34 168.97 0.13 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.902 0.382 . . . . 0.0 111.16 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 50.7 p90 -59.44 -178.47 0.06 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.979 -179.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 21.5 t -124.54 127.5 72.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.02 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -70.23 136.08 49.61 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.899 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -104.8 159.68 15.6 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.991 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 26.9 m -98.45 31.13 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.117 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -132.76 31.55 3.94 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.917 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -119.84 78.6 1.35 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.892 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 24.0 tt0 . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.268 -0.872 . . . . 0.0 110.921 -179.995 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 3.2 p . . . . . 0 N--CA 1.487 1.409 0 CA-C-O 120.866 0.365 . . . . 0.0 111.229 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . 0.729 ' HG3' HD11 ' A' ' 23' ' ' LEU . 1.9 tmm? -59.14 118.84 6.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.862 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -121.01 111.13 17.09 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.142 -179.819 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 45.8 mt -110.68 125.6 67.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.848 179.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.8 p -134.04 160.58 37.31 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.123 179.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.431 ' HB3' ' HB2' ' A' ' 40' ' ' LEU . 39.3 p -163.5 140.54 7.25 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.462 -179.557 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.1 mttp -101.13 33.62 2.8 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.032 -179.615 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -140.62 -50.39 0.45 Allowed 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.53 179.584 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 7.7 mtm -120.6 -174.45 2.81 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.606 179.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -111.62 171.84 7.25 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.766 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.8 mm -90.93 112.6 25.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 121.063 0.459 . . . . 0.0 111.054 -179.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 15.9 p -98.69 153.05 38.09 Favored Pre-proline 0 C--N 1.325 -0.468 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.886 179.608 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_exo -58.61 -17.1 33.38 Favored 'Trans proline' 0 C--N 1.345 0.342 0 C-N-CA 122.379 2.052 . . . . 0.0 111.879 179.139 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.34 -42.53 20.4 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-O 121.022 0.439 . . . . 0.0 110.44 179.399 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.474 ' O ' HG23 ' A' ' 19' ' ' VAL . 36.1 mt -72.81 -28.34 26.97 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 CA-C-N 115.747 -0.661 . . . . 0.0 109.376 178.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 1.8 mmm180 -75.2 -46.27 35.05 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.627 178.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 51.9 tp60 -67.72 -38.53 83.73 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.714 179.096 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.491 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 81.2 t60 -60.11 -61.43 2.61 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 179.049 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.61 HG12 HD21 ' A' ' 23' ' ' LEU . 29.7 t -60.75 -47.01 95.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 116.622 -0.263 . . . . 0.0 110.552 178.909 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.678 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -57.52 -42.64 83.21 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 111.753 0.279 . . . . 0.0 111.753 179.702 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.491 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 1.0 OUTLIER -59.96 -33.28 71.71 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 120.64 -0.424 . . . . 0.0 110.287 179.916 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 27.2 mmt180 -75.02 -28.03 60.32 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.056 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.729 HD11 ' HG3' ' A' ' 2' ' ' MET . 3.6 mt -68.85 -54.05 17.92 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.004 0.43 . . . . 0.0 110.408 179.397 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.62 -24.31 63.71 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.813 -0.631 . . . . 0.0 111.188 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -79.5 -30.88 42.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.112 0.482 . . . . 0.0 110.286 179.41 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.558 ' HB3' ' HB2' ' A' ' 29' ' ' TRP . 37.2 mt -79.77 58.43 2.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.793 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -56.27 -75.3 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.519 -179.563 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.442 ' HD2' ' CD2' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -51.44 -27.3 9.87 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.182 0.515 . . . . 0.0 111.308 -179.513 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.639 ' HB3' HD13 ' A' ' 84' ' ' LEU . 13.5 m95 -90.72 36.05 0.9 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.475 -179.922 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.814 ' HA ' HD11 ' A' ' 33' ' ' LEU . 8.0 mt-30 -139.32 59.95 1.59 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.014 0.435 . . . . 0.0 110.355 179.685 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -78.29 90.99 4.37 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.051 -179.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 70.5 m-70 62.81 -85.23 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.584 179.647 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 1.047 HD23 HG22 ' A' ' 55' ' ' THR . 0.2 OUTLIER 62.71 143.93 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 -179.318 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.903 HD13 ' O ' ' A' ' 33' ' ' LEU . 1.8 mm -135.5 110.07 11.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 121.604 0.716 . . . . 0.0 112.15 -179.597 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 25.4 m-20 52.76 77.61 0.44 Allowed Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 114.69 -1.141 . . . . 0.0 112.61 178.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.593 ' HB3' HG23 ' A' ' 53' ' ' ILE . 89.6 Cg_endo -80.91 130.67 7.62 Favored 'Trans proline' 0 N--CA 1.462 -0.375 0 C-N-CA 122.587 2.191 . . . . 0.0 111.279 178.539 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . 0.487 ' O ' HD13 ' A' ' 38' ' ' ILE . 0.5 OUTLIER -109.7 132.46 54.12 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.119 0.485 . . . . 0.0 112.153 -178.904 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.701 HD12 ' CB ' ' A' ' 51' ' ' ALA . 10.8 mm -121.51 133.3 68.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.263 179.232 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.529 ' C ' HD22 ' A' ' 40' ' ' LEU . 3.8 mt -123.77 139.2 51.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 120.981 0.419 . . . . 0.0 111.5 -179.375 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.609 HD11 HG12 ' A' ' 73' ' ' ILE . 3.2 mm? -116.93 128.1 54.88 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.727 179.844 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.2 m -124.2 -175.2 3.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.6 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.436 ' HG3' ' CD2' ' A' ' 47' ' ' PHE . 13.5 tttm -158.4 140.15 13.73 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.365 0.602 . . . . 0.0 111.157 -179.558 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 60.1 mt-10 -131.5 156.11 80.56 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 115.105 -0.952 . . . . 0.0 109.313 179.19 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_exo -51.5 -24.67 17.3 Favored 'Trans proline' 0 N--CA 1.464 -0.24 0 C-N-CA 121.906 1.737 . . . . 0.0 112.435 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -89.61 -6.69 56.01 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.437 -0.801 . . . . 0.0 112.749 -179.122 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 150.36 -163.9 29.64 Favored Glycine 0 C--O 1.225 -0.443 0 C-N-CA 120.227 -0.987 . . . . 0.0 112.275 179.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.436 ' CD2' ' HG3' ' A' ' 42' ' ' LYS . 18.9 m-85 -109.07 154.43 22.26 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.559 0.695 . . . . 0.0 111.987 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.555 HG22 ' HG2' ' A' ' 65' ' ' LYS . 68.0 t -127.94 139.57 51.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 114.787 -1.097 . . . . 0.0 110.941 -179.391 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -131.14 124.06 29.89 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.597 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -120.08 147.03 45.36 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.658 0.266 . . . . 0.0 110.986 -179.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.701 ' CB ' HD12 ' A' ' 38' ' ' ILE . . . -144.35 140.92 29.39 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.829 0.347 . . . . 0.0 111.387 179.738 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.0 m -136.33 131.3 34.13 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.253 179.469 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.683 HG21 HD22 ' A' ' 33' ' ' LEU . 15.3 mt -132.45 135.59 57.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 120.865 0.364 . . . . 0.0 111.252 -179.604 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -104.11 121.16 42.65 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.648 179.372 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 1.047 HG22 HD23 ' A' ' 33' ' ' LEU . 7.6 p -116.29 155.03 48.83 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.622 179.791 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_exo -65.33 -11.92 32.44 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.515 2.143 . . . . 0.0 112.528 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 8.5 m-80 -112.37 -4.3 14.31 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 111.732 0.271 . . . . 0.0 111.732 -179.697 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 162.32 -166.98 36.72 Favored Glycine 0 C--N 1.331 0.27 0 C-N-CA 120.388 -0.91 . . . . 0.0 112.82 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 34.8 t -129.98 140.36 49.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 120.835 0.35 . . . . 0.0 111.134 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -118.34 142.58 47.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.818 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.435 ' O ' ' NE2' ' A' ' 83' ' ' GLN . 11.1 p -140.67 146.61 23.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.935 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.513 ' O ' HD12 ' A' ' 76' ' ' LEU . . . -155.85 152.68 28.66 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.265 0.555 . . . . 0.0 111.698 -179.798 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 67.1 m -143.23 160.46 40.43 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.709 -179.347 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.7 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -155.18 105.77 0.28 Allowed Glycine 0 CA--C 1.519 0.289 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.566 179.548 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.555 ' HG2' HG22 ' A' ' 48' ' ' VAL . 1.1 mtmp? -107.73 44.47 1.09 Allowed 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.1 0.408 . . . . 0.0 112.1 -178.812 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 14.6 t-80 -75.72 156.33 34.78 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.578 -0.283 . . . . 0.0 110.415 178.598 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -60.07 -27.28 66.84 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.673 0.273 . . . . 0.0 111.199 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -98.33 120.46 38.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.944 0.402 . . . . 0.0 111.475 -179.438 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.439 ' O ' HD12 ' A' ' 73' ' ' ILE . 13.3 ttt -48.2 -46.72 35.4 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.591 179.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 44.3 m-85 -66.47 -40.97 89.63 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.293 -179.418 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 86.8 m -65.26 -38.68 91.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.746 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.7 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -62.13 -50.71 70.8 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.8 179.607 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.609 HG12 HD11 ' A' ' 40' ' ' LEU . 7.0 mt -61.53 -43.78 97.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.788 0.327 . . . . 0.0 110.352 179.543 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -63.52 -40.25 96.55 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.246 179.339 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.12 -42.68 88.84 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.381 179.367 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.565 HD11 ' N ' ' A' ' 51' ' ' ALA . 0.2 OUTLIER -52.19 -62.0 1.91 Allowed 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 109.881 -0.415 . . . . 0.0 109.881 179.036 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 46.3 mt -55.05 -30.29 23.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 178.71 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -59.55 -29.58 68.02 Favored 'General case' 0 N--CA 1.442 -0.856 0 CA-C-O 121.22 0.533 . . . . 0.0 110.298 178.188 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.98 -28.34 22.73 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.354 179.155 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.786 ' O ' HD12 ' A' ' 84' ' ' LEU . 97.3 mt -63.7 -50.31 69.69 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 177.737 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -60.0 -50.67 72.83 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 114.907 -1.042 . . . . 0.0 111.057 177.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.52 -32.63 73.6 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.898 -179.349 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.435 ' NE2' ' O ' ' A' ' 61' ' ' VAL . 41.4 mt-30 -74.2 -42.54 59.63 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.619 179.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.786 HD12 ' O ' ' A' ' 80' ' ' LEU . 1.6 mt -65.55 -29.2 69.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.462 179.464 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -63.25 -28.25 69.9 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.568 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.457 ' HA ' ' CD2' ' A' ' 89' ' ' HIS . 25.9 mmtt -72.38 -17.52 61.81 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.249 -179.818 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 61.3 mt -69.64 -16.68 63.42 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.327 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 -76.26 -22.9 54.58 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.906 0.384 . . . . 0.0 111.272 -179.755 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.457 ' CD2' ' HA ' ' A' ' 86' ' ' LYS . 16.1 m-70 -85.79 -38.69 17.91 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.764 179.82 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.96 -21.05 63.29 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.125 -179.768 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -77.77 59.21 3.82 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.589 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -122.11 -38.83 2.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.941 0.401 . . . . 0.0 110.9 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -131.74 -59.35 0.95 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.0 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 4.7 ttp180 62.78 124.55 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.982 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 10.2 mtp180 -159.36 -46.3 0.05 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.902 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . 59.53 77.72 0.3 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.058 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -110.47 108.14 18.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.088 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 25.6 p -109.33 164.06 12.82 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.883 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.5 m -62.5 178.84 0.38 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.827 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 23.0 m -116.27 145.16 22.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.143 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -112.59 123.91 51.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.937 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -177.88 75.5 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.854 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -160.65 137.81 9.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.167 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 62.73 17.22 9.63 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.351 179.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 1.7 t80 48.08 94.5 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.829 0.347 . . . . 0.0 111.29 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 27.4 t -71.99 107.16 2.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.004 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -139.76 138.69 36.12 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.801 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 59.22 91.55 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.926 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 15.3 m -143.61 128.15 14.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.141 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -99.39 72.74 1.83 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.807 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 14.9 tt0 -163.84 113.36 1.25 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.896 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 . . . . . 0 C--O 1.248 1.006 0 CA-C-O 118.239 -0.886 . . . . 0.0 110.96 -179.983 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 11.6 t . . . . . 0 N--CA 1.487 1.377 0 CA-C-O 120.714 0.292 . . . . 0.0 111.307 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . 0.584 ' HG2' HD11 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -103.9 -177.97 3.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.978 179.984 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -122.38 112.98 18.75 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.392 -179.7 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.468 HG22 ' CD1' ' A' ' 11' ' ' ILE . 34.8 mt -109.97 126.75 67.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.539 179.419 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -134.38 162.25 32.75 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.862 0.363 . . . . 0.0 111.133 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 38.9 p -164.36 136.27 4.63 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.548 -179.739 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.6 mtpp -102.33 18.68 20.4 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.195 -179.737 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -141.72 20.61 2.17 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 120.881 0.372 . . . . 0.0 110.927 179.465 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 177.31 -177.99 0.18 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.545 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -117.84 160.22 21.77 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.855 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.468 ' CD1' HG22 ' A' ' 4' ' ' ILE . 3.4 mm -92.28 118.54 38.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.012 -179.746 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.492 ' H ' HD12 ' A' ' 15' ' ' ILE . 13.7 p -100.11 149.87 36.39 Favored Pre-proline 0 C--N 1.326 -0.424 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.701 179.528 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -56.23 -18.99 25.84 Favored 'Trans proline' 0 C--N 1.343 0.288 0 C-N-CA 122.4 2.067 . . . . 0.0 112.131 179.405 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.78 -39.93 25.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.069 0.461 . . . . 0.0 110.443 179.485 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.492 HD12 ' H ' ' A' ' 12' ' ' THR . 21.5 mt -72.93 -31.69 36.86 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.216 178.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.422 ' O ' ' CB ' ' A' ' 20' ' ' ALA . 0.2 OUTLIER -72.14 -47.37 51.49 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.537 178.854 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -66.94 -35.6 80.35 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.535 178.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.428 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 79.4 t60 -58.65 -65.27 0.69 Allowed 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 178.831 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.955 HG13 HD11 ' A' ' 77' ' ' ILE . 20.3 t -61.2 -46.17 97.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.819 178.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.616 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -55.37 -49.85 71.23 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 111.782 0.29 . . . . 0.0 111.782 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.428 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 3.2 p30 -58.58 -29.16 66.21 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.815 0.34 . . . . 0.0 110.709 -179.709 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.572 ' O ' HD12 ' A' ' 26' ' ' LEU . 41.9 mmt180 -75.14 -28.66 60.24 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.575 179.337 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.702 HD21 HG12 ' A' ' 19' ' ' VAL . 1.1 mt -69.41 -49.6 53.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.985 0.421 . . . . 0.0 110.529 179.148 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.35 -28.03 66.47 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.168 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.1 ttmm -79.53 -32.73 42.3 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.96 0.41 . . . . 0.0 110.587 179.356 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.579 HD23 ' CD1' ' A' ' 29' ' ' TRP . 5.4 mt -81.0 57.36 3.07 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.782 179.814 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -64.4 -63.73 1.06 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.2 -179.715 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.436 ' HD2' ' CZ3' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -48.31 -27.4 2.51 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.395 0.617 . . . . 0.0 111.068 179.997 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.924 ' HB3' HD13 ' A' ' 84' ' ' LEU . 53.9 m95 -86.0 -35.81 20.15 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 114.961 -1.018 . . . . 0.0 111.938 -179.258 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.423 ' O ' ' N ' ' A' ' 32' ' ' HIS . 0.0 OUTLIER -55.21 -56.65 17.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.831 0.348 . . . . 0.0 110.565 179.805 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.461 HG22 ' O ' ' A' ' 29' ' ' TRP . 0.0 OUTLIER 38.78 -90.56 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.769 -0.65 . . . . 0.0 112.044 179.738 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . 0.423 ' N ' ' O ' ' A' ' 30' ' ' GLN . 35.2 m-70 -129.38 117.63 20.9 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.047 0.451 . . . . 0.0 111.467 -179.589 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.985 HD22 HG21 ' A' ' 53' ' ' ILE . 24.3 mt -147.05 147.91 31.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.923 179.319 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.602 HD12 ' C ' ' A' ' 33' ' ' LEU . 4.1 mp -144.87 119.16 3.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-O 121.683 0.754 . . . . 0.0 112.177 -179.511 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 11.9 m120 70.69 55.23 0.44 Allowed Pre-proline 0 C--N 1.327 -0.412 0 CA-C-N 114.502 -1.226 . . . . 0.0 111.938 178.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -65.09 129.26 22.55 Favored 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 122.186 1.924 . . . . 0.0 111.947 -179.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -139.44 127.7 22.65 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.934 0.397 . . . . 0.0 111.687 -179.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.645 ' N ' HD12 ' A' ' 38' ' ' ILE . 3.3 mp -120.86 136.57 57.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.627 179.573 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 23.1 mt -116.91 146.13 21.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.075 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.3 mt -123.26 128.18 49.62 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.759 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 20.1 m -125.21 -172.45 2.59 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.388 179.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.448 ' HG3' ' CE2' ' A' ' 47' ' ' PHE . 0.0 OUTLIER -162.55 145.28 11.05 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.367 0.603 . . . . 0.0 111.249 -179.878 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -133.57 169.89 12.78 Favored Pre-proline 0 C--N 1.322 -0.624 0 CA-C-N 115.052 -0.976 . . . . 0.0 109.322 179.339 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -61.71 -25.81 79.22 Favored 'Trans proline' 0 N--CA 1.464 -0.253 0 C-N-CA 121.91 1.74 . . . . 0.0 112.088 179.633 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -90.45 -8.39 50.65 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.273 -0.876 . . . . 0.0 113.044 -178.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 152.47 -169.06 31.62 Favored Glycine 0 C--O 1.225 -0.46 0 C-N-CA 120.065 -1.064 . . . . 0.0 112.515 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.448 ' CE2' ' HG3' ' A' ' 42' ' ' LYS . 10.7 m-85 -106.02 153.95 21.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.597 0.713 . . . . 0.0 112.162 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.597 HG22 ' HG2' ' A' ' 65' ' ' LYS . 54.3 t -127.58 141.39 46.5 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 CA-C-N 114.665 -1.152 . . . . 0.0 110.97 -179.322 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.444 ' O ' ' HA ' ' A' ' 63' ' ' SER . . . -133.05 123.2 25.34 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.549 179.642 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -119.56 150.77 39.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.648 0.261 . . . . 0.0 110.854 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.558 ' N ' HD11 ' A' ' 76' ' ' LEU . . . -147.44 139.73 24.51 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.75 0.309 . . . . 0.0 111.151 179.589 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 4.5 m -135.14 133.27 39.01 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.328 -0.397 . . . . 0.0 110.171 179.583 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.985 HG21 HD22 ' A' ' 33' ' ' LEU . 18.5 mt -134.52 135.6 53.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.039 0.447 . . . . 0.0 111.387 -179.731 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -104.28 119.66 39.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.458 179.137 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.854 HG22 HD23 ' A' ' 33' ' ' LEU . 7.2 p -112.51 167.07 9.73 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.975 -179.906 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_exo -71.37 -7.84 22.13 Favored 'Trans proline' 0 C--N 1.343 0.279 0 C-N-CA 122.899 2.4 . . . . 0.0 112.636 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -120.19 -4.41 10.0 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 111.776 0.287 . . . . 0.0 111.776 -179.589 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 160.61 -169.76 36.41 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.44 -0.886 . . . . 0.0 112.74 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.573 HG13 ' O ' ' A' ' 53' ' ' ILE . 15.9 t -130.07 143.3 41.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.781 0.324 . . . . 0.0 111.119 -179.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.4 mt -118.35 151.37 37.86 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.044 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.4 ' O ' ' NE2' ' A' ' 83' ' ' GLN . 21.4 t -140.57 143.55 28.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.887 179.882 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.445 ' O ' HD12 ' A' ' 76' ' ' LEU . . . -150.95 151.7 32.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.037 0.446 . . . . 0.0 111.603 -179.767 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.444 ' HA ' ' O ' ' A' ' 49' ' ' ALA . 2.0 t -145.09 155.74 43.51 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.722 -179.423 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.786 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -149.73 102.07 0.23 Allowed Glycine 0 C--N 1.331 0.279 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.609 179.413 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.597 ' HG2' HG22 ' A' ' 48' ' ' VAL . 5.5 mtmp? -103.84 44.55 1.01 Allowed 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -178.804 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.561 ' ND1' HG21 ' A' ' 71' ' ' THR . 12.2 t-80 -75.55 155.64 35.83 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 110.131 -0.322 . . . . 0.0 110.131 178.426 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -60.95 -26.73 67.74 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.731 0.3 . . . . 0.0 111.425 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -97.29 122.17 40.02 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.024 0.44 . . . . 0.0 111.426 -179.314 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 2.5 ttt -47.98 -51.01 25.47 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.891 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 15.9 m-85 -65.89 -37.6 86.55 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.567 -179.122 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.561 HG21 ' ND1' ' A' ' 66' ' ' HIS . 87.5 m -64.7 -41.16 96.21 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.791 0.329 . . . . 0.0 110.649 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.786 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -61.48 -48.2 82.21 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.439 179.607 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.418 ' CG2' HG22 ' A' ' 19' ' ' VAL . 15.7 mt -60.3 -45.47 96.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.869 0.366 . . . . 0.0 110.387 179.635 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -64.29 -39.6 94.25 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.5 179.449 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -65.28 -45.07 85.97 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.449 179.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.558 HD11 ' N ' ' A' ' 51' ' ' ALA . 0.3 OUTLIER -52.57 -58.2 7.53 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 179.129 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.955 HD11 HG13 ' A' ' 19' ' ' VAL . 34.7 mt -57.2 -32.45 40.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 178.82 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -59.0 -28.61 66.54 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-O 121.148 0.499 . . . . 0.0 110.174 178.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.17 -26.84 24.92 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.118 179.151 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.735 HD12 ' HA ' ' A' ' 77' ' ' ILE . 64.9 mt -62.86 -50.01 72.62 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 107.931 -1.137 . . . . 0.0 107.931 177.424 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.442 ' HG3' ' CD1' ' A' ' 29' ' ' TRP . 5.8 tt0 -60.87 -44.67 96.75 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 114.598 -1.183 . . . . 0.0 110.571 177.711 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 1.1 ptt180 -62.85 -37.59 87.46 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.165 -179.557 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.4 ' NE2' ' O ' ' A' ' 61' ' ' VAL . 35.3 mt-30 -74.28 -40.52 62.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.68 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.924 HD13 ' HB3' ' A' ' 29' ' ' TRP . 3.3 mt -64.79 -24.25 67.49 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.682 179.657 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 17.8 t-20 -62.47 -27.73 69.33 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.42 179.592 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 8.0 mmtt -72.92 -18.42 61.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.205 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.407 HD12 ' HA ' ' A' ' 84' ' ' LEU . 18.7 mt -68.79 -52.71 27.35 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.893 0.378 . . . . 0.0 110.551 179.814 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -77.03 -12.51 59.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.042 179.617 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.411 ' O ' ' CB ' ' A' ' 90' ' ' LYS . 2.2 m80 66.61 -71.37 0.09 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.086 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.411 ' CB ' ' O ' ' A' ' 89' ' ' HIS . 0.0 OUTLIER 80.58 30.27 0.2 Allowed 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.835 179.991 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 166.52 78.5 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.522 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.661 ' HG3' ' HB2' ' A' ' 96' ' ' ALA . 6.9 pt-20 -117.58 170.52 8.69 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.832 0.348 . . . . 0.0 110.938 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -144.15 -65.07 0.36 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.114 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.03 -37.2 85.28 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.924 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 4.3 ttm180 -68.21 -45.81 72.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.909 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.661 ' HB2' ' HG3' ' A' ' 92' ' ' GLU . . . -61.29 160.2 11.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.11 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -154.58 36.4 0.41 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.141 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -131.83 -48.79 0.95 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.892 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 48.2 p -143.03 133.69 25.14 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.895 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 8.9 p -107.61 -26.28 3.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.233 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.73 98.12 6.87 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.927 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -143.98 -57.13 0.38 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.877 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -121.09 -68.93 0.87 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.027 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 45.2 m-20 62.53 -80.74 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.103 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 64.23 -79.06 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.974 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.439 HG23 ' N ' ' A' ' 107' ' ' GLU . 15.4 m -138.32 -45.36 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.142 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . 0.439 ' N ' HG23 ' A' ' 106' ' ' VAL . 17.1 mt-10 63.06 94.26 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.837 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 29.2 mm-40 -88.64 99.99 12.75 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.936 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 10.6 p -163.0 137.9 1.38 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.03 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -138.58 77.2 1.61 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.962 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -105.09 -31.33 9.22 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.841 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 13.6 tt0 . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.208 -0.901 . . . . 0.0 110.89 -179.995 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 3.7 t . . . . . 0 N--CA 1.486 1.346 0 CA-C-O 120.78 0.324 . . . . 0.0 111.212 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.29 137.29 36.58 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.841 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -120.78 98.8 6.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.15 -179.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.493 ' CG2' HD11 ' A' ' 40' ' ' LEU . 34.2 mt -102.63 124.16 56.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.643 179.586 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.8 p -134.25 159.58 40.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.987 0.422 . . . . 0.0 111.097 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 21.5 p -163.86 143.8 8.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.668 -179.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.6 mtmp? -102.51 35.89 2.32 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.035 -179.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -141.11 -47.63 0.4 Allowed 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.777 179.718 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 14.3 mtm -126.22 176.44 7.07 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.691 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -99.79 173.96 6.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.828 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 6.0 mm -91.77 110.76 23.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 121.097 0.475 . . . . 0.0 111.075 -179.677 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 13.2 p -97.52 149.5 35.78 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.146 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_exo -55.84 -20.59 29.51 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.423 2.082 . . . . 0.0 111.746 179.06 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -76.15 -43.92 40.67 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.046 0.45 . . . . 0.0 110.339 179.242 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.653 ' O ' HG23 ' A' ' 19' ' ' VAL . 32.2 mt -72.34 -27.85 27.37 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.283 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.58 179.118 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 29.4 ttt-85 -77.45 -43.68 31.6 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.714 -0.676 . . . . 0.0 109.531 178.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 34.3 tt0 -67.64 -40.69 84.58 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.638 179.067 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.529 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 79.5 t60 -60.99 -57.32 13.13 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.711 -0.395 . . . . 0.0 109.964 179.167 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.738 HG13 HD11 ' A' ' 77' ' ' ILE . 26.9 t -60.35 -47.81 90.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 178.675 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.707 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -59.72 -40.12 86.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.208 -0.451 . . . . 0.0 112.087 179.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.529 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 0.9 OUTLIER -59.59 -35.33 74.09 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 120.497 -0.481 . . . . 0.0 109.999 179.918 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.913 ' O ' HD12 ' A' ' 26' ' ' LEU . 0.5 OUTLIER -76.42 -27.21 56.18 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.775 179.557 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.707 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 5.3 mt -66.48 -56.03 12.82 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.046 0.45 . . . . 0.0 110.225 179.509 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.26 -21.62 64.08 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.162 179.555 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 6.0 tmtm? -79.24 -29.3 42.63 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.686 179.61 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.913 HD12 ' O ' ' A' ' 22' ' ' ARG . 0.4 OUTLIER -78.31 61.15 2.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.666 -179.991 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.36 -52.08 66.75 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.751 -0.658 . . . . 0.0 111.869 -179.448 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.465 ' HG2' ' NE1' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -86.46 28.05 0.89 Allowed 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 120.853 0.359 . . . . 0.0 111.466 -179.595 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.672 ' HB3' HD13 ' A' ' 84' ' ' LEU . 10.0 m95 -149.62 161.98 41.11 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.361 -179.527 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.611 ' HG3' HD11 ' A' ' 33' ' ' LEU . 1.0 OUTLIER 61.19 27.2 16.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.454 -179.284 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 8.8 t -79.99 -23.11 41.8 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.521 -179.661 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . 0.669 ' O ' HD23 ' A' ' 33' ' ' LEU . 2.1 p80 -123.27 69.43 1.01 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.999 0.428 . . . . 0.0 111.01 -179.823 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.728 HD22 HG21 ' A' ' 53' ' ' ILE . 23.4 mt -129.1 154.73 46.41 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.334 179.702 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.584 HD12 ' O ' ' A' ' 54' ' ' ASN . 3.5 mp -139.49 100.06 1.3 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.809 0.338 . . . . 0.0 111.479 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.543 ' ND2' HG22 ' A' ' 34' ' ' ILE . 36.2 m-20 61.81 71.72 0.72 Allowed Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.372 179.643 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -75.17 151.73 39.12 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.532 2.154 . . . . 0.0 111.844 179.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -138.61 126.52 22.42 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.945 0.402 . . . . 0.0 111.521 -179.647 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.64 ' N ' HD12 ' A' ' 38' ' ' ILE . 3.4 mp -118.88 135.71 58.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.626 179.521 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 5.3 mt -116.73 147.08 20.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.227 -179.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.493 HD11 ' CG2' ' A' ' 4' ' ' ILE . 3.3 mt -121.9 127.23 50.21 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.696 179.785 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -124.1 -172.42 2.54 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.482 179.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.426 ' HG3' ' CD2' ' A' ' 47' ' ' PHE . 1.5 ttpt -161.52 139.52 9.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.299 0.571 . . . . 0.0 111.274 -179.686 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -130.81 157.54 77.55 Favored Pre-proline 0 C--N 1.323 -0.553 0 CA-C-N 115.189 -0.914 . . . . 0.0 109.306 179.159 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 70.9 Cg_exo -51.48 -24.63 17.1 Favored 'Trans proline' 0 N--CA 1.464 -0.215 0 C-N-CA 122.012 1.808 . . . . 0.0 112.464 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.5 tt0 -89.2 -6.08 57.18 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.479 -0.782 . . . . 0.0 112.659 -179.14 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 148.86 -160.91 28.56 Favored Glycine 0 C--O 1.224 -0.511 0 C-N-CA 120.289 -0.957 . . . . 0.0 112.224 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.456 ' CD1' ' N ' ' A' ' 47' ' ' PHE . 13.6 m-85 -110.17 154.74 22.91 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.574 0.702 . . . . 0.0 112.096 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.698 HG22 ' HG3' ' A' ' 65' ' ' LYS . 93.7 t -127.22 140.0 50.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 114.691 -1.141 . . . . 0.0 111.036 -179.012 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -131.49 122.19 25.76 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.41 179.402 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -120.3 149.32 42.49 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.691 0.281 . . . . 0.0 111.071 -179.639 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.579 ' N ' HD11 ' A' ' 76' ' ' LEU . . . -146.55 140.04 25.84 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.815 0.341 . . . . 0.0 111.32 179.535 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.0 m -134.33 131.86 38.83 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.031 179.484 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.728 HG21 HD22 ' A' ' 33' ' ' LEU . 21.9 mt -132.25 136.22 56.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 121.043 0.449 . . . . 0.0 111.676 -179.427 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.584 ' O ' HD12 ' A' ' 34' ' ' ILE . 8.3 m120 -100.97 120.74 40.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.596 179.142 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.497 ' HB ' ' HD2' ' A' ' 56' ' ' PRO . 5.5 p -113.46 173.4 2.89 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.244 179.862 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.497 ' HD2' ' HB ' ' A' ' 55' ' ' THR . 86.5 Cg_endo -86.98 1.67 7.29 Favored 'Trans proline' 0 N--CA 1.457 -0.642 0 C-N-CA 122.353 2.036 . . . . 0.0 112.632 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 5.0 m120 -131.58 20.95 4.68 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.315 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 139.99 -167.57 25.35 Favored Glycine 0 C--N 1.331 0.265 0 C-N-CA 120.603 -0.808 . . . . 0.0 112.646 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 19.0 t -128.68 144.12 39.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.757 0.313 . . . . 0.0 111.178 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 16.7 mt -118.33 144.4 45.89 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.026 -179.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 21.6 t -140.26 144.69 27.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.147 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.436 ' O ' HD12 ' A' ' 76' ' ' LEU . . . -153.37 149.77 28.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.063 0.459 . . . . 0.0 111.419 -179.805 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.417 ' HA ' HD12 ' A' ' 76' ' ' LEU . 56.0 p -145.08 159.93 42.19 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.866 -179.239 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.608 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -150.96 107.33 0.34 Allowed Glycine 0 C--N 1.333 0.371 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.713 179.408 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.698 ' HG3' HG22 ' A' ' 48' ' ' VAL . 0.7 OUTLIER -105.25 43.99 1.07 Allowed 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.062 0.393 . . . . 0.0 112.062 -178.813 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.445 ' CE1' HG21 ' A' ' 71' ' ' THR . 13.0 t-80 -77.45 155.51 31.71 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.713 0.292 . . . . 0.0 110.561 179.2 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -61.08 -26.91 67.98 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.337 179.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -98.68 118.99 36.65 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.983 0.42 . . . . 0.0 111.401 -179.313 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.8 tmt? -48.01 -45.77 32.21 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.547 179.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 34.4 m-85 -66.52 -41.05 89.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.222 -179.483 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.445 HG21 ' CE1' ' A' ' 66' ' ' HIS . 90.7 m -65.26 -38.28 89.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.877 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.608 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -62.25 -50.82 70.22 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.87 179.762 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.455 HD11 HD22 ' A' ' 40' ' ' LEU . 8.6 mt -62.01 -42.65 95.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.713 0.292 . . . . 0.0 110.275 179.511 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -63.91 -41.89 97.55 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.957 0.408 . . . . 0.0 110.1 179.206 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -65.93 -41.4 91.41 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.506 179.494 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.579 HD11 ' N ' ' A' ' 51' ' ' ALA . 0.3 OUTLIER -53.45 -62.92 1.34 Allowed 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 179.218 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.738 HD11 HG13 ' A' ' 19' ' ' VAL . 42.8 mt -54.74 -27.21 18.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 110.227 -0.286 . . . . 0.0 110.227 178.831 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -58.99 -39.98 83.46 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 178.0 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.424 ' HB2' ' HB1' ' A' ' 62' ' ' ALA . 0.0 OUTLIER -72.1 -30.62 65.27 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 114.844 -1.071 . . . . 0.0 109.944 178.613 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.846 ' O ' HD12 ' A' ' 84' ' ' LEU . 94.5 mt -63.66 -46.63 84.75 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 107.899 -1.148 . . . . 0.0 107.899 177.575 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 8.2 tt0 -59.98 -51.97 67.41 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 114.894 -1.048 . . . . 0.0 110.628 177.791 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.93 -25.43 68.14 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.384 -179.655 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -74.71 -47.6 30.52 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.837 0.351 . . . . 0.0 110.774 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.846 HD12 ' O ' ' A' ' 80' ' ' LEU . 1.1 mt -64.59 -25.37 67.94 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.809 179.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 -63.47 -33.29 75.25 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.923 0.392 . . . . 0.0 110.386 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.49 -31.9 63.99 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.491 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.563 ' O ' HD23 ' A' ' 87' ' ' LEU . 6.5 tt -68.77 -27.89 66.29 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.964 -179.899 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.462 ' O ' ' N ' ' A' ' 90' ' ' LYS . 21.0 mt-30 -80.91 -32.98 34.5 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.948 0.404 . . . . 0.0 111.24 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.478 ' CE1' ' O ' ' A' ' 87' ' ' LEU . 0.0 OUTLIER 42.88 -87.73 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.604 -179.447 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.462 ' N ' ' O ' ' A' ' 88' ' ' GLN . 1.8 mmmm 47.41 -174.78 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 120.929 0.395 . . . . 0.0 111.442 -179.946 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 162.94 -83.73 0.11 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.68 -0.771 . . . . 0.0 112.465 -179.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -117.99 -175.74 2.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.825 0.345 . . . . 0.0 110.894 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -153.96 157.51 39.27 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.119 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -83.84 136.97 33.92 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.89 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.82 36.48 22.03 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.931 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.527 ' HA ' HG11 ' A' ' 100' ' ' VAL . . . -92.5 123.95 36.19 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.026 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -138.62 -55.9 0.62 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.139 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 28.3 m -131.54 -58.62 0.98 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.823 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 4.2 m -128.62 119.78 25.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.777 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.527 HG11 ' HA ' ' A' ' 96' ' ' ALA . 13.8 m -150.02 31.07 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.104 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 20.0 tttt -92.32 140.09 29.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.88 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 13.1 p-10 -74.9 167.31 22.12 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.882 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -130.29 172.98 11.24 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.056 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -60.32 145.15 48.75 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.923 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 29.0 m-85 -82.89 146.63 28.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.979 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 21.4 t -98.15 -45.56 12.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.041 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . 0.46 ' HB3' HG13 ' A' ' 109' ' ' VAL . 2.5 mp0 -92.53 -18.12 23.56 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.262 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 65.07 34.1 9.02 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.866 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.497 HG23 ' O ' ' A' ' 109' ' ' VAL . 27.0 m -98.07 117.68 43.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.053 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 61.52 167.96 0.1 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.831 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -97.71 -31.7 12.13 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.897 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 . . . . . 0 C--O 1.25 1.107 0 CA-C-O 118.253 -0.88 . . . . 0.0 110.916 -179.974 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.488 1.44 0 CA-C-O 120.781 0.324 . . . . 0.0 111.194 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . 0.722 ' SD ' HD11 ' A' ' 23' ' ' LEU . 2.9 ttp -59.39 136.59 58.02 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.89 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 43.9 t-20 -127.85 98.87 5.31 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.3 -179.819 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.913 HG22 ' HB ' ' A' ' 38' ' ' ILE . 18.3 pt -105.09 130.0 56.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.459 179.331 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 3.1 p -132.9 169.93 16.06 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.879 0.371 . . . . 0.0 111.052 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.443 ' HB3' ' HB2' ' A' ' 40' ' ' LEU . 25.0 p -162.84 136.71 6.14 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.314 -179.441 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -101.15 37.26 1.8 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.952 -179.781 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -140.82 -48.98 0.43 Allowed 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.592 179.625 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -123.11 174.27 7.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.55 179.78 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.5 pm0 -93.95 165.17 12.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.518 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.5 mm -90.98 114.33 28.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 121.012 0.434 . . . . 0.0 110.983 -179.514 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 11.2 p -99.57 150.0 36.39 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.004 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -56.98 -19.24 31.47 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.318 2.012 . . . . 0.0 111.755 178.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -76.8 -42.77 39.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.092 0.473 . . . . 0.0 110.257 179.27 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.562 ' O ' HG23 ' A' ' 19' ' ' VAL . 31.9 mt -72.62 -28.59 28.16 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 CA-C-N 115.575 -0.739 . . . . 0.0 109.446 178.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.41 ' O ' ' CB ' ' A' ' 20' ' ' ALA . 53.2 mtp180 -74.82 -45.84 40.7 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.609 178.696 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -67.35 -38.52 84.95 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.616 179.158 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.448 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 77.8 t60 -60.25 -61.74 2.38 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 179.075 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.796 HG13 HD11 ' A' ' 77' ' ' ILE . 18.9 t -60.56 -47.18 93.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 116.618 -0.264 . . . . 0.0 110.676 178.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.689 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -58.14 -44.91 88.1 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.354 0.501 . . . . 0.0 112.354 -179.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.448 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 0.9 OUTLIER -59.83 -32.84 71.03 Favored 'General case' 0 C--N 1.333 -0.146 0 C-N-CA 120.364 -0.534 . . . . 0.0 110.219 -179.542 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.547 ' O ' HD12 ' A' ' 26' ' ' LEU . 0.0 OUTLIER -73.1 -28.44 62.28 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.652 179.181 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.722 HD11 ' SD ' ' A' ' 2' ' ' MET . 5.1 mt -68.44 -53.86 20.8 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.954 0.406 . . . . 0.0 110.599 179.536 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.34 -23.81 62.82 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.233 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -79.22 -33.36 43.77 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 121.206 0.527 . . . . 0.0 110.113 179.346 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.892 HD23 ' CD1' ' A' ' 29' ' ' TRP . 6.1 mt -80.23 57.12 2.65 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.047 -179.718 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.36 -72.03 0.14 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.3 -179.861 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.44 ' HE2' ' CH2' ' A' ' 29' ' ' TRP . 3.1 tttt -52.82 -24.12 8.34 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.239 0.542 . . . . 0.0 111.105 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.892 ' CD1' HD23 ' A' ' 26' ' ' LEU . 37.6 m95 -84.03 -78.14 0.24 Allowed 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.875 -179.682 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.882 ' HA ' HD11 ' A' ' 33' ' ' LEU . 60.9 mt-30 -81.24 55.67 2.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.835 0.35 . . . . 0.0 111.207 -179.589 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.416 HG23 ' N ' ' A' ' 32' ' ' HIS . 5.9 t -80.39 -47.22 14.74 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.934 0.397 . . . . 0.0 110.584 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . 0.654 ' O ' HD12 ' A' ' 33' ' ' LEU . 0.4 OUTLIER -91.59 -126.33 0.09 Allowed 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.664 179.818 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.892 ' O ' HD13 ' A' ' 34' ' ' ILE . 0.6 OUTLIER 73.34 152.51 0.13 Allowed 'General case' 0 N--CA 1.464 0.227 0 O-C-N 122.213 -0.304 . . . . 0.0 110.688 -179.696 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.892 HD13 ' O ' ' A' ' 33' ' ' LEU . 2.8 mm -137.54 99.04 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-O 120.739 0.304 . . . . 0.0 111.519 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 61.08 78.1 0.33 Allowed Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.639 179.35 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.551 ' HB3' HG23 ' A' ' 53' ' ' ILE . 92.9 Cg_endo -80.54 154.43 20.94 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.652 2.235 . . . . 0.0 112.0 179.316 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -138.34 127.95 24.94 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.976 0.417 . . . . 0.0 111.411 -179.617 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.913 ' HB ' HG22 ' A' ' 4' ' ' ILE . 4.9 mp -120.32 137.2 54.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.929 179.708 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 28.1 mt -119.54 142.21 35.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.172 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.89 HD21 ' CG1' ' A' ' 73' ' ' ILE . 10.0 mt -120.36 130.15 54.27 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.97 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 14.9 m -125.22 -170.65 2.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.528 179.786 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.427 ' HG3' ' CD2' ' A' ' 47' ' ' PHE . 3.5 ttpt -158.67 141.41 14.44 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.431 0.634 . . . . 0.0 111.359 -179.7 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -131.32 156.86 79.56 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 115.113 -0.949 . . . . 0.0 109.217 179.143 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_exo -51.82 -24.46 18.54 Favored 'Trans proline' 0 C--O 1.232 0.198 0 C-N-CA 121.942 1.761 . . . . 0.0 112.375 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 34.5 tt0 -89.44 -6.71 56.28 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.501 -0.772 . . . . 0.0 112.778 -179.146 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 149.22 -162.56 29.02 Favored Glycine 0 C--O 1.225 -0.422 0 C-N-CA 120.269 -0.967 . . . . 0.0 112.205 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.427 ' CD2' ' HG3' ' A' ' 42' ' ' LYS . 18.5 m-85 -109.06 152.65 24.74 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.548 0.689 . . . . 0.0 112.026 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.648 HG22 ' CG ' ' A' ' 65' ' ' LYS . 63.8 t -126.51 141.01 47.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 114.829 -1.078 . . . . 0.0 110.912 -179.324 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -132.13 123.78 27.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.753 179.645 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.403 ' O ' HG23 ' A' ' 38' ' ' ILE . 2.7 m-20 -119.52 149.84 41.24 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.603 0.24 . . . . 0.0 110.855 -179.81 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.53 ' N ' HD11 ' A' ' 76' ' ' LEU . . . -147.3 139.89 24.78 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.72 0.295 . . . . 0.0 111.419 179.615 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.0 m -135.78 129.88 33.19 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.924 -0.399 . . . . 0.0 109.924 179.226 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.7 HG21 ' CD2' ' A' ' 33' ' ' LEU . 8.3 mt -133.03 140.42 47.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-O 121.177 0.513 . . . . 0.0 111.96 -179.326 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 8.6 m120 -100.89 118.72 37.49 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.496 -0.774 . . . . 0.0 110.775 179.212 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.4 ' HA ' ' HD3' ' A' ' 56' ' ' PRO . 5.9 p -111.05 146.27 34.16 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.153 179.327 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 55' ' ' THR . 32.3 Cg_exo -58.01 -17.52 31.51 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.27 1.98 . . . . 0.0 112.573 -179.451 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -118.67 23.68 11.33 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.581 -0.282 . . . . 0.0 111.572 -179.714 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 143.99 -165.2 27.38 Favored Glycine 0 C--N 1.331 0.263 0 C-N-CA 120.427 -0.892 . . . . 0.0 113.073 179.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.566 HG13 ' O ' ' A' ' 53' ' ' ILE . 18.4 t -139.84 142.77 31.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.802 0.334 . . . . 0.0 111.015 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.9 mt -118.64 146.39 44.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.947 0.403 . . . . 0.0 111.299 -179.659 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 21.6 t -139.37 145.3 27.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.807 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -154.03 151.64 29.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.2 0.524 . . . . 0.0 111.648 -179.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.441 ' HA ' HD12 ' A' ' 76' ' ' LEU . 0.8 OUTLIER -143.13 156.71 44.85 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.416 -0.811 . . . . 0.0 111.575 -179.393 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.599 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -151.43 105.86 0.29 Allowed Glycine 0 C--N 1.331 0.305 0 N-CA-C 111.487 -0.645 . . . . 0.0 111.487 179.443 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.648 ' CG ' HG22 ' A' ' 48' ' ' VAL . 0.1 OUTLIER -107.92 45.06 1.03 Allowed 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.433 0.531 . . . . 0.0 112.433 -178.806 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 15.2 t-80 -75.74 156.15 34.89 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.732 0.301 . . . . 0.0 110.353 178.552 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -60.61 -27.48 67.78 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.323 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -97.89 120.73 38.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.031 0.443 . . . . 0.0 111.461 -179.307 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -48.15 -48.21 34.41 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.724 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 8.2 m-85 -66.4 -41.16 89.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.332 -179.338 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 60.1 m -64.99 -39.49 93.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.798 0.333 . . . . 0.0 110.699 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.599 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -61.72 -50.42 72.49 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.672 179.642 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.89 ' CG1' HD21 ' A' ' 40' ' ' LEU . 8.5 mt -60.87 -43.56 95.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.88 0.372 . . . . 0.0 110.324 179.515 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -63.93 -38.87 92.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.091 179.272 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -66.17 -44.77 83.08 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.409 179.343 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.53 HD11 ' N ' ' A' ' 51' ' ' ALA . 0.3 OUTLIER -51.4 -58.97 4.8 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 179.038 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.796 HD11 HG13 ' A' ' 19' ' ' VAL . 43.5 mt -57.36 -29.32 32.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 109.916 -0.402 . . . . 0.0 109.916 178.6 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -58.84 -30.54 67.75 Favored 'General case' 0 N--CA 1.442 -0.859 0 CA-C-O 121.192 0.52 . . . . 0.0 109.932 178.079 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.5 mptt -84.0 -27.93 28.07 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.387 -0.824 . . . . 0.0 109.834 178.612 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.717 ' O ' HD12 ' A' ' 84' ' ' LEU . 89.8 mt -63.74 -49.55 72.6 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 177.493 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.439 ' HG3' ' CD1' ' A' ' 29' ' ' TRP . 9.0 tt0 -60.26 -50.18 74.67 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 114.862 -1.063 . . . . 0.0 110.501 177.616 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.88 -25.14 68.15 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.098 -179.741 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 8.4 mt-30 -75.33 -45.68 37.97 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.926 0.393 . . . . 0.0 110.42 179.759 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.852 HD13 ' HB3' ' A' ' 29' ' ' TRP . 1.1 mt -65.81 -30.98 71.69 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.83 179.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 47.1 t30 -61.82 -27.75 68.99 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.698 -179.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.427 ' HA ' ' CD2' ' A' ' 89' ' ' HIS . 2.9 mmtt -72.59 -23.66 60.99 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.142 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.477 HD12 ' HA ' ' A' ' 84' ' ' LEU . 19.9 mt -69.56 -15.5 63.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.265 -179.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -76.62 -7.13 54.63 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.624 -0.262 . . . . 0.0 111.364 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.427 ' CD2' ' HA ' ' A' ' 86' ' ' LYS . 64.6 m-70 -85.16 -67.78 0.78 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.786 0.327 . . . . 0.0 110.865 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 42.11 -164.39 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.601 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 118.22 35.77 0.99 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.518 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -108.03 96.3 6.28 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.804 0.335 . . . . 0.0 110.912 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -78.24 -28.52 47.85 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.152 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 10.1 mmt-85 -59.24 113.73 2.29 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.941 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.04 158.78 15.35 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.942 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -81.93 96.89 7.82 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.149 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -69.27 91.19 0.52 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.085 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 63.58 138.81 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.87 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -178.42 94.72 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.871 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.448 ' O ' HG23 ' A' ' 100' ' ' VAL . 10.6 m -138.28 79.9 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.125 180.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 3.2 pttt -112.3 -35.14 5.69 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.946 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 41.2 m-20 -89.62 139.1 30.88 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.906 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . 60.5 95.13 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.147 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 17.3 t-20 -115.07 75.11 0.91 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.885 179.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -165.66 -168.93 1.42 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.956 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 28.8 t -121.74 82.03 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.039 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -67.97 -64.51 0.85 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.839 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -148.97 -66.61 0.23 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.876 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.432 HG23 ' O ' ' A' ' 109' ' ' VAL . 5.4 m -140.23 100.16 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.137 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -118.83 -41.72 2.77 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.904 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -145.78 166.17 26.69 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.935 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 . . . . . 0 C--O 1.25 1.102 0 CA-C-O 118.212 -0.899 . . . . 0.0 110.866 179.976 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 8.6 t . . . . . 0 N--CA 1.487 1.412 0 CA-C-O 120.738 0.304 . . . . 0.0 111.146 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . 0.47 ' HE1' ' HA ' ' A' ' 16' ' ' ARG . 0.1 OUTLIER -143.27 166.01 25.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.95 179.955 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -124.87 130.56 52.61 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.196 -179.795 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.432 HD11 ' SD ' ' A' ' 2' ' ' MET . 38.7 mt -132.7 126.84 55.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.833 179.867 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -133.63 162.2 32.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.988 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.424 ' HB3' ' HB2' ' A' ' 40' ' ' LEU . 21.5 p -164.08 136.92 5.1 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.631 -179.581 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.94 39.26 1.49 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.797 -179.891 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -140.6 -47.81 0.42 Allowed 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.687 179.824 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -133.64 -178.36 4.97 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.898 179.792 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -93.23 164.03 13.39 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.671 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 3.7 mm -90.31 121.05 40.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.886 0.374 . . . . 0.0 110.695 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 17.7 p -101.81 148.21 34.97 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.086 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -56.77 -19.75 32.35 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.413 2.076 . . . . 0.0 111.773 179.203 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -77.61 -40.66 41.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.223 0.535 . . . . 0.0 110.374 179.618 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 26.4 mt -73.09 -31.27 34.4 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.327 178.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.47 ' HA ' ' HE1' ' A' ' 2' ' ' MET . 6.8 mtt85 -72.64 -46.45 53.99 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.512 178.616 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -67.09 -34.81 78.44 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.332 178.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.431 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 78.7 t60 -59.4 -66.02 0.58 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.039 0.447 . . . . 0.0 109.968 178.909 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.683 HG12 HD21 ' A' ' 23' ' ' LEU . 15.7 t -61.41 -46.04 97.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.887 179.166 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.639 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -55.56 -48.25 75.07 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 111.601 0.222 . . . . 0.0 111.601 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.431 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 2.7 p30 -59.51 -28.82 67.39 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.885 0.374 . . . . 0.0 110.538 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.616 ' O ' HD12 ' A' ' 26' ' ' LEU . 18.2 mmt180 -74.75 -29.2 61.07 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.517 179.451 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.683 HD21 HG12 ' A' ' 19' ' ' VAL . 1.1 mt -69.44 -49.65 53.06 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.594 179.185 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.87 -24.96 62.85 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.915 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.45 -37.41 43.65 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.569 179.315 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.616 HD12 ' O ' ' A' ' 22' ' ' ARG . 2.6 mt -82.27 55.92 3.04 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.81 179.625 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -118.15 20.96 13.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.564 -179.745 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.63 -6.24 33.69 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.754 0.312 . . . . 0.0 111.195 179.74 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.895 ' CD1' HD13 ' A' ' 84' ' ' LEU . 30.8 m95 -86.61 -175.77 5.56 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.033 -179.756 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 2.1 mm100 -128.32 74.3 1.54 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.296 0.57 . . . . 0.0 111.161 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.699 ' O ' HD13 ' A' ' 33' ' ' LEU . 14.9 t -162.32 87.52 0.63 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.088 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . 0.446 ' O ' HG22 ' A' ' 55' ' ' THR . 12.2 m-70 -48.2 101.25 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.636 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.891 HD22 ' H ' ' A' ' 33' ' ' LEU . 0.6 OUTLIER -64.98 128.0 33.93 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.044 -0.525 . . . . 0.0 109.76 -179.868 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.807 HG22 ' ND2' ' A' ' 35' ' ' ASN . 6.1 mt -127.5 116.61 44.24 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.259 0 CA-C-O 121.811 0.815 . . . . 0.0 112.143 -178.744 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.807 ' ND2' HG22 ' A' ' 34' ' ' ILE . 28.5 m-80 73.45 48.0 0.22 Allowed Pre-proline 0 C--N 1.322 -0.615 0 CA-C-N 114.227 -1.352 . . . . 0.0 111.922 178.834 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.443 ' CD ' ' N ' ' A' ' 35' ' ' ASN . 16.0 Cg_endo -57.93 129.17 31.96 Favored 'Trans proline' 0 C--N 1.343 0.289 0 C-N-CA 122.207 1.938 . . . . 0.0 111.745 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . 0.443 ' O ' HD13 ' A' ' 38' ' ' ILE . 2.0 t-160 -134.01 132.63 40.33 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.03 0.443 . . . . 0.0 111.521 -179.711 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.443 HD13 ' O ' ' A' ' 37' ' ' HIS . 24.5 mm -123.19 133.7 68.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.773 179.726 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 37.0 mt -120.63 142.21 37.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.875 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.564 HD21 ' CG1' ' A' ' 73' ' ' ILE . 6.1 mt -121.48 127.41 51.04 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.988 0.423 . . . . 0.0 110.813 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -124.47 -171.35 2.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.602 179.813 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.482 ' HA ' ' HA ' ' A' ' 47' ' ' PHE . 0.0 OUTLIER -172.73 146.33 1.62 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.191 0.52 . . . . 0.0 111.018 -179.758 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.438 ' HB3' ' HD2' ' A' ' 44' ' ' PRO . 30.2 mm-40 -131.9 166.89 25.0 Favored Pre-proline 0 C--N 1.324 -0.527 0 CA-C-N 115.415 -0.811 . . . . 0.0 109.11 179.137 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . 0.438 ' HD2' ' HB3' ' A' ' 43' ' ' GLU . 71.4 Cg_exo -49.35 -20.35 3.69 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 121.764 1.643 . . . . 0.0 112.443 -179.327 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 28.9 tt0 -85.44 -76.89 0.31 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.122 179.156 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . 0.445 ' HA3' ' HA ' ' A' ' 67' ' ' GLU . . . -142.44 -156.79 6.91 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.688 -0.767 . . . . 0.0 112.645 -179.339 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.482 ' HA ' ' HA ' ' A' ' 42' ' ' LYS . 21.4 m-85 -108.17 151.05 26.44 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.607 0.718 . . . . 0.0 112.58 -179.315 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.525 HG22 ' HG2' ' A' ' 65' ' ' LYS . 63.5 t -124.61 142.61 40.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 114.543 -1.208 . . . . 0.0 110.537 -179.775 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.439 ' O ' ' HA ' ' A' ' 63' ' ' SER . . . -133.09 125.17 29.0 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.026 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -118.39 145.69 44.98 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.356 179.765 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.753 ' CB ' HD11 ' A' ' 76' ' ' LEU . . . -144.69 142.2 29.89 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.798 -0.361 . . . . 0.0 111.602 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.604 ' O ' HD13 ' A' ' 53' ' ' ILE . 9.2 m -136.14 135.6 39.38 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.582 179.735 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.647 ' O ' HG13 ' A' ' 59' ' ' VAL . 4.0 mm -132.51 133.63 59.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.709 0.29 . . . . 0.0 110.915 -179.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -108.98 121.81 45.92 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.529 179.386 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.611 HG21 ' OG1' ' A' ' 31' ' ' THR . 28.4 p -121.67 164.99 21.49 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.1 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.41 ' HD3' ' O ' ' A' ' 32' ' ' HIS . 20.0 Cg_exo -65.9 -11.73 32.18 Favored 'Trans proline' 0 C--N 1.343 0.288 0 C-N-CA 122.785 2.323 . . . . 0.0 112.763 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -111.06 -3.39 15.51 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 111.819 0.303 . . . . 0.0 111.819 -179.601 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 152.39 -167.2 31.34 Favored Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.467 -0.873 . . . . 0.0 112.765 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.647 HG13 ' O ' ' A' ' 53' ' ' ILE . 17.2 t -131.95 140.65 47.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.73 0.3 . . . . 0.0 111.144 -179.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.7 mt -117.54 153.81 32.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.889 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 13.8 p -140.42 149.62 21.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.307 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.502 ' O ' HD12 ' A' ' 76' ' ' LEU . . . -153.99 154.73 34.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.098 0.475 . . . . 0.0 111.411 -179.824 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.439 ' HA ' ' O ' ' A' ' 49' ' ' ALA . 0.1 OUTLIER -144.79 157.31 44.22 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.753 -179.315 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.762 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -151.87 105.16 0.28 Allowed Glycine 0 C--N 1.331 0.304 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.61 179.4 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.525 ' HG2' HG22 ' A' ' 48' ' ' VAL . 8.7 mtpt -107.62 44.73 1.06 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -178.65 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.651 ' ND1' HG21 ' A' ' 71' ' ' THR . 13.9 t-80 -76.18 156.29 33.8 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.877 0.37 . . . . 0.0 110.421 178.522 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.445 ' HA ' ' HA3' ' A' ' 46' ' ' GLY . 1.2 tt0 -60.88 -26.9 67.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.786 0.327 . . . . 0.0 111.119 179.844 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -97.59 123.93 41.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.028 0.442 . . . . 0.0 111.458 -179.292 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 17.1 ttt -48.2 -50.27 29.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.834 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . 0.404 ' HA ' HD12 ' A' ' 73' ' ' ILE . 46.4 m-85 -66.24 -36.74 83.79 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.635 -179.118 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.651 HG21 ' ND1' ' A' ' 66' ' ' HIS . 98.7 m -64.34 -42.28 96.35 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.721 0.296 . . . . 0.0 110.529 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.762 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -61.2 -47.52 85.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.37 179.442 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.604 ' CG2' HG22 ' A' ' 19' ' ' VAL . 14.7 mt -60.35 -47.11 93.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.548 179.645 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -63.96 -39.14 93.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.596 179.65 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -65.49 -44.97 85.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.469 179.576 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.753 HD11 ' CB ' ' A' ' 51' ' ' ALA . 0.2 OUTLIER -53.01 -57.84 9.0 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 179.194 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.603 HD11 HG13 ' A' ' 19' ' ' VAL . 9.3 mt -57.01 -31.97 38.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 178.824 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -59.11 -30.06 67.83 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-O 121.139 0.495 . . . . 0.0 110.324 178.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.483 ' HB2' ' HB1' ' A' ' 62' ' ' ALA . 3.8 mptt -84.65 -25.71 28.31 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.217 179.092 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.439 HD12 ' HA ' ' A' ' 77' ' ' ILE . 90.5 mt -62.21 -48.87 78.08 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 107.599 -1.26 . . . . 0.0 107.599 177.111 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.709 ' HA ' HD12 ' A' ' 84' ' ' LEU . 4.2 tt0 -60.22 -44.63 95.03 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 114.362 -1.29 . . . . 0.0 110.549 177.585 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 85.3 mtt180 -61.59 -31.38 71.43 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.882 -179.703 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 17.0 mt-30 -75.61 -39.78 57.39 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.936 0.398 . . . . 0.0 110.438 179.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.895 HD13 ' CD1' ' A' ' 29' ' ' TRP . 6.5 mt -66.09 -30.33 70.82 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.826 179.611 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -63.69 -22.64 67.01 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.908 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.467 ' O ' ' CG ' ' A' ' 89' ' ' HIS . 5.6 mmtm -71.59 -35.01 70.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.62 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.734 HD12 ' HA ' ' A' ' 84' ' ' LEU . 1.7 mt -72.36 -22.6 61.13 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.259 179.755 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -77.85 1.74 19.43 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.493 0.553 . . . . 0.0 112.493 -179.113 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.467 ' CG ' ' O ' ' A' ' 86' ' ' LYS . 0.7 OUTLIER -79.55 168.49 19.34 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.135 0.493 . . . . 0.0 111.512 -179.414 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -171.1 74.82 0.06 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.898 179.532 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 162.99 94.24 0.1 OUTLIER Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.488 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -73.37 80.97 1.39 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.85 0.357 . . . . 0.0 110.954 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . 59.42 94.65 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.203 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.88 165.7 0.06 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.894 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 10.6 mtm180 -141.35 -48.89 0.4 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.934 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -139.84 126.71 20.74 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.102 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . 60.45 -176.15 0.11 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.134 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 1.2 p -82.33 -63.23 1.42 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.855 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 67.5 m -128.23 148.46 50.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.853 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 29.5 t -80.18 82.54 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.112 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 30.3 mmtm -94.19 -34.61 12.85 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.89 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . 0.472 ' HB2' HG12 ' A' ' 106' ' ' VAL . 71.3 m-20 -75.76 149.31 38.01 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.893 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -115.79 154.36 29.77 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.057 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 68.99 -67.47 0.21 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.912 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -139.1 114.35 9.6 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.791 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.472 HG12 ' HB2' ' A' ' 102' ' ' ASP . 27.4 m -69.11 -35.75 70.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.176 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -156.69 167.71 29.62 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.843 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -103.55 -74.6 0.63 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.868 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 11.1 p -67.18 142.43 16.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.091 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -120.28 137.98 53.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.913 179.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -102.43 -48.39 4.18 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.962 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.203 -0.903 . . . . 0.0 110.84 -179.997 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 2.2 m . . . . . 0 N--CA 1.487 1.416 0 CA-C-O 120.844 0.354 . . . . 0.0 111.173 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . 0.531 ' SD ' HD11 ' A' ' 23' ' ' LEU . 2.5 tpt 60.18 87.77 0.08 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.852 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -124.24 116.49 22.76 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.484 -179.651 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 35.2 mt -118.98 125.23 74.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.396 179.389 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -134.35 162.63 31.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.907 0.384 . . . . 0.0 111.313 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.452 ' HB3' ' HB2' ' A' ' 40' ' ' LEU . 21.5 p -162.32 143.25 10.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.35 -179.744 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -102.81 -11.79 18.05 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.626 -179.452 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.03 -25.07 14.43 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 120.757 0.313 . . . . 0.0 111.132 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 1.4 mpp? -137.69 -165.98 1.87 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.871 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 13.6 tt0 -124.02 164.54 19.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.64 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.515 HG22 ' HG3' ' A' ' 16' ' ' ARG . 4.9 mm -91.2 111.32 23.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 121.075 0.464 . . . . 0.0 111.223 -179.497 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 15.1 p -98.22 152.72 38.13 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.034 179.807 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -58.5 -18.82 41.23 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.416 2.077 . . . . 0.0 111.757 179.278 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -79.19 -43.19 24.39 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.976 0.417 . . . . 0.0 110.519 179.27 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.48 ' O ' HG23 ' A' ' 19' ' ' VAL . 30.4 mt -72.26 -28.8 29.95 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.412 178.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.515 ' HG3' HG22 ' A' ' 11' ' ' ILE . 19.5 mtm180 -74.63 -44.98 47.83 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.569 178.797 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 19.0 tt0 -67.69 -39.25 84.44 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.761 179.094 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.534 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 78.2 t60 -60.14 -58.18 9.64 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.623 -0.431 . . . . 0.0 109.881 179.018 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.859 HG13 HD11 ' A' ' 77' ' ' ILE . 44.3 t -60.86 -47.54 92.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-O 120.714 0.293 . . . . 0.0 110.258 178.453 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.693 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -58.25 -42.74 87.07 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.204 0.446 . . . . 0.0 112.204 179.77 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.534 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 0.9 OUTLIER -59.2 -35.83 74.3 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 121.007 0.432 . . . . 0.0 110.243 -179.898 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.559 ' O ' HD12 ' A' ' 26' ' ' LEU . 5.2 mmm180 -76.09 -25.98 56.0 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.581 179.458 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.693 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 3.3 mt -68.31 -56.93 6.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.136 0.493 . . . . 0.0 110.393 179.542 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.08 -25.04 66.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.675 -179.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 7.8 tmtm? -79.11 -41.03 29.58 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.057 0.456 . . . . 0.0 110.506 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.709 ' HB3' ' HB2' ' A' ' 29' ' ' TRP . 7.0 mt -81.04 55.02 2.36 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.688 179.788 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -50.93 -63.97 0.96 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.375 -179.654 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.464 ' HG2' ' CD1' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -51.57 -34.22 36.0 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.296 0.569 . . . . 0.0 111.152 -179.891 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.709 ' HB2' ' HB3' ' A' ' 26' ' ' LEU . 9.2 m95 -90.01 48.71 1.61 Allowed 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.293 -0.867 . . . . 0.0 111.31 -179.581 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.632 ' HG2' HD12 ' A' ' 33' ' ' LEU . 3.5 mt-30 170.92 97.91 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.347 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.43 ' CG2' ' N ' ' A' ' 32' ' ' HIS . 2.0 t -159.56 -47.78 0.05 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.018 -179.709 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . 0.43 ' N ' ' CG2' ' A' ' 31' ' ' THR . 18.0 m170 -82.35 -18.27 42.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.901 179.761 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.818 HD22 HG21 ' A' ' 53' ' ' ILE . 53.6 mt -57.44 153.85 11.96 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.863 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.493 HG22 ' OD1' ' A' ' 35' ' ' ASN . 29.0 mt -140.48 104.15 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.425 -179.911 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.493 ' OD1' HG22 ' A' ' 34' ' ' ILE . 6.6 m120 57.71 76.77 0.45 Allowed Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.281 179.579 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -79.32 152.52 23.73 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.607 2.205 . . . . 0.0 112.022 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 2.0 t-160 -136.64 127.21 26.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.121 -179.7 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.634 ' N ' HD12 ' A' ' 38' ' ' ILE . 3.3 mp -119.58 135.24 60.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.92 179.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.53 ' C ' HD22 ' A' ' 40' ' ' LEU . 5.5 mt -116.54 142.94 27.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.808 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.53 HD22 ' C ' ' A' ' 39' ' ' ILE . 3.7 mm? -116.29 127.47 54.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.068 -179.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -123.5 -174.71 3.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.303 179.586 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.433 ' HG3' ' CD2' ' A' ' 47' ' ' PHE . 2.2 ttpp -159.99 139.35 11.05 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.282 0.563 . . . . 0.0 111.303 -179.731 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -130.9 156.07 80.56 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-N 115.091 -0.958 . . . . 0.0 109.241 179.161 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_exo -51.34 -24.39 15.77 Favored 'Trans proline' 0 N--CA 1.465 -0.186 0 C-N-CA 121.936 1.757 . . . . 0.0 112.464 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.31 -6.56 56.61 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.439 -0.8 . . . . 0.0 112.654 -179.177 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 149.82 -162.42 29.13 Favored Glycine 0 C--O 1.224 -0.483 0 C-N-CA 120.248 -0.977 . . . . 0.0 112.222 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.433 ' CD2' ' HG3' ' A' ' 42' ' ' LYS . 17.9 m-85 -110.01 154.55 23.02 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.425 0.631 . . . . 0.0 111.986 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.668 HG22 ' CB ' ' A' ' 65' ' ' LYS . 55.4 t -129.19 139.04 52.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 114.966 -1.015 . . . . 0.0 111.064 -179.297 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.403 ' O ' ' HA ' ' A' ' 63' ' ' SER . . . -129.82 123.34 30.67 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.265 179.47 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -119.08 149.67 41.29 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.718 0.294 . . . . 0.0 111.051 -179.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.473 ' N ' HD11 ' A' ' 76' ' ' LEU . . . -145.85 140.16 26.86 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.437 179.746 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.1 m -134.86 130.72 36.43 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.018 179.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.818 HG21 HD22 ' A' ' 33' ' ' LEU . 6.7 mt -132.69 137.3 54.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 121.047 0.451 . . . . 0.0 111.68 -179.478 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -102.28 134.96 44.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.796 179.283 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.47 HG22 HD23 ' A' ' 33' ' ' LEU . 6.0 p -129.88 160.55 64.46 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.418 179.75 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.45 ' HG3' HD11 ' A' ' 34' ' ' ILE . 16.2 Cg_exo -67.59 -10.51 28.97 Favored 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.461 2.108 . . . . 0.0 112.687 -179.68 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -115.79 -3.94 12.18 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 111.801 0.297 . . . . 0.0 111.801 -179.697 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 159.25 -167.12 34.91 Favored Glycine 0 C--N 1.331 0.282 0 C-N-CA 120.391 -0.909 . . . . 0.0 112.82 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.534 HG13 ' O ' ' A' ' 53' ' ' ILE . 15.4 t -131.64 140.89 47.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 120.802 0.334 . . . . 0.0 111.163 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.712 HD23 ' HB3' ' A' ' 83' ' ' GLN . 6.5 mp -116.47 151.6 35.75 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.045 -179.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 14.1 p -139.96 149.05 22.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.147 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -154.93 150.2 27.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.302 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.527 ' HA ' HD12 ' A' ' 76' ' ' LEU . 0.9 OUTLIER -145.8 156.49 43.62 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.783 -179.402 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.781 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -150.04 104.6 0.28 Allowed Glycine 0 CA--C 1.519 0.335 0 N-CA-C 111.37 -0.692 . . . . 0.0 111.37 179.287 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.668 ' CB ' HG22 ' A' ' 48' ' ' VAL . 6.0 mtmt -106.93 45.11 1.0 Allowed 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -178.625 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.57 ' ND1' HG21 ' A' ' 71' ' ' THR . 12.3 t-80 -75.72 156.91 34.23 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 178.572 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.4 pm0 -60.17 -27.24 66.95 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.759 0.314 . . . . 0.0 111.263 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -98.63 118.43 35.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.975 0.417 . . . . 0.0 111.301 -179.553 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 11.5 ttt -47.43 -45.04 25.3 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.559 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 8.5 m-85 -66.7 -39.67 88.17 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.072 -179.716 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.57 HG21 ' ND1' ' A' ' 66' ' ' HIS . 93.2 m -65.41 -38.79 91.02 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.73 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.781 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -61.62 -50.8 71.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.758 179.644 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.61 HG21 HG22 ' A' ' 19' ' ' VAL . 6.8 mt -62.08 -41.18 90.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-O 120.741 0.305 . . . . 0.0 110.243 179.355 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -64.06 -41.72 97.26 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.923 0.392 . . . . 0.0 110.047 179.096 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 62.0 mt-10 -67.26 -41.08 86.17 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.829 179.502 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.527 HD12 ' HA ' ' A' ' 63' ' ' SER . 0.4 OUTLIER -54.64 -64.78 0.72 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.326 179.662 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.859 HD11 HG13 ' A' ' 19' ' ' VAL . 55.5 mt -55.85 -26.79 21.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.567 -0.288 . . . . 0.0 110.272 178.929 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -58.53 -39.62 80.66 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 178.066 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.16 -30.86 63.88 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.834 -1.076 . . . . 0.0 110.287 178.754 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.818 ' O ' HD12 ' A' ' 84' ' ' LEU . 90.3 mt -61.66 -45.2 95.06 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 107.61 -1.256 . . . . 0.0 107.61 177.451 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.422 ' O ' ' CZ3' ' A' ' 29' ' ' TRP . 21.9 tt0 -57.33 -52.57 64.83 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 114.807 -1.088 . . . . 0.0 110.287 177.332 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 39.7 mtt180 -65.18 -16.55 63.64 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.566 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.712 ' HB3' HD23 ' A' ' 60' ' ' LEU . 8.2 mt-30 -75.44 -55.3 5.83 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.564 0.221 . . . . 0.0 111.067 -179.826 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.818 HD12 ' O ' ' A' ' 80' ' ' LEU . 2.5 mp -64.12 -27.68 69.25 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.089 0.471 . . . . 0.0 110.456 179.62 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.476 ' N ' ' HZ3' ' A' ' 29' ' ' TRP . 11.8 t-20 -61.92 -36.27 80.87 Favored 'General case' 0 CA--C 1.521 -0.157 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.352 -179.27 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.435 ' O ' ' CG ' ' A' ' 89' ' ' HIS . 8.4 mmtm -73.0 -33.0 65.51 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.11 -179.757 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.586 HD12 ' HA ' ' A' ' 84' ' ' LEU . 2.7 mt -70.0 -12.19 61.43 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.558 -179.88 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 7.2 mt-30 -77.63 -8.76 58.36 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 111.979 0.362 . . . . 0.0 111.979 -179.493 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.457 ' CD2' ' HG2' ' A' ' 90' ' ' LYS . 1.1 p-80 -85.93 175.6 8.53 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.961 0.41 . . . . 0.0 111.326 -179.831 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.457 ' HG2' ' CD2' ' A' ' 89' ' ' HIS . 6.1 mmmt 76.59 -67.9 0.2 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.083 179.64 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 98.39 87.21 1.88 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.283 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 63.16 117.98 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.833 0.349 . . . . 0.0 110.76 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.17 -70.88 0.25 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.117 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 11.0 ptt-85 -146.46 121.92 10.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.863 180.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.45 -32.32 6.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.924 -179.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -130.86 147.86 52.56 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.149 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -173.99 107.22 0.13 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.095 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . 0.474 HG22 ' H ' ' A' ' 99' ' ' SER . 0.2 OUTLIER 60.12 -176.31 0.1 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.931 179.974 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . 0.474 ' H ' HG22 ' A' ' 98' ' ' THR . 3.1 p -157.17 -46.0 0.07 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.865 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 9.0 p -104.32 -25.63 3.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.142 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 3.6 mtpm? 61.46 175.92 0.12 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.914 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -133.91 32.12 3.54 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.968 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.69 -31.39 72.59 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.077 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . 0.689 ' HB3' HG22 ' A' ' 109' ' ' VAL . 2.1 m-80 -153.25 -46.97 0.09 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.889 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.487 ' O ' HG13 ' A' ' 106' ' ' VAL . 2.1 t80 -176.42 -54.8 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.908 180.0 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.487 HG13 ' O ' ' A' ' 105' ' ' PHE . 6.1 m -157.42 89.93 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.107 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 60.8 50.65 5.25 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.857 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 44.0 mm-40 60.72 112.47 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.952 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.689 HG22 ' HB3' ' A' ' 104' ' ' ASN . 8.0 m -115.76 135.43 55.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.085 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -130.63 122.69 27.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.881 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -111.76 -34.55 6.0 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.921 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.243 -0.884 . . . . 0.0 110.9 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . 0.432 ' O ' HG23 ' A' ' 1' ' ' THR . 9.2 t . . . . . 0 N--CA 1.487 1.376 0 CA-C-O 120.841 0.353 . . . . 0.0 111.173 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . 0.71 ' CG ' HD11 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -126.95 175.63 7.92 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.944 179.887 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 39.4 t-20 -113.56 142.17 46.29 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.485 -179.689 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.639 ' CG2' HD11 ' A' ' 40' ' ' LEU . 21.2 mt -131.37 123.84 53.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.597 179.499 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.8 p -134.92 157.5 46.7 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.947 0.403 . . . . 0.0 111.31 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.46 ' HB3' HD12 ' A' ' 40' ' ' LEU . 21.7 p -163.32 143.32 8.82 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.508 -179.733 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.4 mtmt -101.05 12.56 37.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.294 -179.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -142.43 25.87 1.83 Allowed 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.801 179.587 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 2.4 mtm 179.37 172.51 0.89 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.859 -179.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 14.0 pm0 -114.9 168.41 9.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.477 179.583 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.631 HG22 ' HG3' ' A' ' 16' ' ' ARG . 6.5 mm -89.94 107.99 18.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 121.061 0.457 . . . . 0.0 111.349 -179.263 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 14.1 p -97.28 150.98 37.4 Favored Pre-proline 0 C--N 1.327 -0.389 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.831 179.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_endo -56.08 -26.8 61.57 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.475 2.117 . . . . 0.0 111.66 179.069 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -71.43 -44.6 64.54 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.634 179.47 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.681 ' O ' HG23 ' A' ' 19' ' ' VAL . 34.7 mt -72.19 -27.92 27.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 178.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.631 ' HG3' HG22 ' A' ' 11' ' ' ILE . 63.1 mtm180 -76.39 -44.63 35.3 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.776 178.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -67.75 -40.37 84.1 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.686 179.14 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.509 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 78.1 t60 -60.57 -58.0 10.35 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 179.07 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.681 HG23 ' O ' ' A' ' 15' ' ' ILE . 22.0 t -60.01 -47.49 91.59 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.447 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 178.554 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.718 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -59.4 -39.66 84.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.934 179.654 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.509 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 0.9 OUTLIER -59.64 -34.75 73.2 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 121.134 0.492 . . . . 0.0 109.924 179.915 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.738 ' O ' HD12 ' A' ' 26' ' ' LEU . 36.5 mmt180 -75.55 -25.4 57.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.713 179.35 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.718 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 14.8 mt -66.98 -55.82 12.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.104 0.478 . . . . 0.0 110.083 179.199 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.57 -21.92 63.12 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.135 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -78.91 -30.58 44.92 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.119 0.485 . . . . 0.0 110.312 179.375 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.738 HD12 ' O ' ' A' ' 22' ' ' ARG . 0.5 OUTLIER -80.29 58.24 3.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.561 179.691 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.45 -79.48 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.647 -179.432 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.443 ' HG3' ' N ' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -49.66 -27.97 5.34 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-O 121.33 0.586 . . . . 0.0 111.164 -179.683 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.582 ' CG ' HD23 ' A' ' 26' ' ' LEU . 10.8 m95 -88.52 52.87 2.55 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.247 -0.888 . . . . 0.0 111.008 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -145.83 50.28 1.19 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.478 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -77.75 -165.63 0.66 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.955 -179.754 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . 0.46 ' O ' HG22 ' A' ' 55' ' ' THR . 47.8 m-70 -50.38 108.18 0.21 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.048 0.451 . . . . 0.0 111.812 -179.34 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.709 HD22 HG21 ' A' ' 53' ' ' ILE . 1.0 OUTLIER -134.95 145.75 48.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.613 179.24 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.621 ' N ' HD12 ' A' ' 34' ' ' ILE . 3.1 mp -137.06 111.33 9.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 121.584 0.707 . . . . 0.0 112.371 -179.382 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.403 HD22 HG22 ' A' ' 34' ' ' ILE . 3.4 m-80 52.53 77.12 0.47 Allowed Pre-proline 0 C--N 1.327 -0.384 0 CA-C-N 114.654 -1.157 . . . . 0.0 112.646 178.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -80.02 145.71 17.72 Favored 'Trans proline' 0 N--CA 1.461 -0.401 0 C-N-CA 122.541 2.161 . . . . 0.0 110.966 178.335 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 1.4 t-160 -134.49 128.91 34.34 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.104 0.478 . . . . 0.0 112.155 -178.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.45 ' N ' HD12 ' A' ' 38' ' ' ILE . 4.9 mp -119.49 133.52 66.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.152 179.189 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.412 HG22 ' N ' ' A' ' 40' ' ' LEU . 38.4 mt -116.43 154.39 18.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.908 0.385 . . . . 0.0 111.51 -179.51 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.639 HD11 ' CG2' ' A' ' 4' ' ' ILE . 0.8 OUTLIER -127.28 126.01 41.89 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.711 179.773 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 3.2 m -123.18 -176.67 3.48 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.655 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.501 ' HG3' ' CE2' ' A' ' 47' ' ' PHE . 0.1 OUTLIER -158.42 138.1 11.97 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.324 0.583 . . . . 0.0 111.26 -179.63 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -130.74 155.49 81.25 Favored Pre-proline 0 C--N 1.322 -0.614 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.393 179.285 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -51.16 -24.69 15.41 Favored 'Trans proline' 0 C--O 1.232 0.221 0 C-N-CA 122.013 1.809 . . . . 0.0 112.372 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.41 -6.5 56.51 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.582 -0.736 . . . . 0.0 112.612 -179.15 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 150.12 -162.58 29.25 Favored Glycine 0 C--O 1.224 -0.477 0 C-N-CA 120.245 -0.978 . . . . 0.0 112.3 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.501 ' CE2' ' HG3' ' A' ' 42' ' ' LYS . 11.3 m-85 -109.92 155.25 21.98 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.435 0.636 . . . . 0.0 111.927 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.635 HG22 ' CB ' ' A' ' 65' ' ' LYS . 49.1 t -129.2 139.09 52.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 114.945 -1.025 . . . . 0.0 111.205 -179.198 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -130.49 122.94 28.58 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.444 179.44 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -119.64 149.77 41.43 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.828 0.347 . . . . 0.0 111.017 -179.672 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.615 ' N ' HD11 ' A' ' 76' ' ' LEU . . . -145.28 139.39 27.06 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.166 179.567 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.0 m -135.43 130.94 35.58 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.251 179.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.709 HG21 HD22 ' A' ' 33' ' ' LEU . 16.1 mt -132.72 135.27 57.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 120.912 0.387 . . . . 0.0 111.412 -179.653 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -103.13 134.49 46.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.442 179.365 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.477 ' HB ' ' HD2' ' A' ' 56' ' ' PRO . 58.1 p -133.07 157.44 78.31 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.561 179.809 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.477 ' HD2' ' HB ' ' A' ' 55' ' ' THR . 43.1 Cg_endo -68.31 -7.34 19.82 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.302 2.001 . . . . 0.0 112.716 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 88.5 m-20 -124.14 22.93 8.58 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.591 0.234 . . . . 0.0 111.604 -179.803 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 138.69 -165.51 25.55 Favored Glycine 0 C--N 1.331 0.294 0 C-N-CA 120.406 -0.902 . . . . 0.0 112.964 179.728 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.495 HG13 ' O ' ' A' ' 53' ' ' ILE . 21.4 t -142.4 144.53 24.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.766 0.317 . . . . 0.0 111.122 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.676 HD21 ' HG ' ' A' ' 84' ' ' LEU . 8.4 mp -118.7 142.82 47.31 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.306 -179.667 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 21.4 t -140.81 142.33 30.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.907 179.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.512 ' O ' HD12 ' A' ' 76' ' ' LEU . . . -153.51 154.39 34.24 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.257 0.551 . . . . 0.0 111.609 -179.708 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 80.3 p -145.09 159.55 42.79 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.828 -179.263 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.789 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -152.61 102.8 0.23 Allowed Glycine 0 C--N 1.331 0.305 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.47 179.466 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.635 ' CB ' HG22 ' A' ' 48' ' ' VAL . 0.0 OUTLIER -105.42 44.33 1.05 Allowed 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -178.771 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 12.5 t-80 -75.23 156.28 35.92 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.589 -0.278 . . . . 0.0 110.253 178.57 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -60.2 -27.25 67.01 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.727 0.299 . . . . 0.0 111.364 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 32.5 t0 -97.66 116.53 30.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.931 0.396 . . . . 0.0 111.191 -179.375 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.41 ' O ' HD12 ' A' ' 73' ' ' ILE . 1.4 ttt -46.92 -44.06 19.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.414 179.821 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -66.81 -42.38 85.98 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.886 -179.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 71.5 m -65.75 -37.51 86.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.917 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.789 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -61.96 -52.93 62.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.958 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.443 HG21 HG22 ' A' ' 19' ' ' VAL . 6.3 mt -61.6 -41.32 89.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.827 0.346 . . . . 0.0 110.235 179.505 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -63.7 -40.0 95.72 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.267 -0.424 . . . . 0.0 109.929 179.068 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -66.35 -41.6 89.3 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.478 179.293 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.711 HD23 HG13 ' A' ' 77' ' ' ILE . 0.2 OUTLIER -52.74 -62.32 1.72 Allowed 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 179.042 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.711 HG13 HD23 ' A' ' 76' ' ' LEU . 4.9 mt -55.9 -29.14 25.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 178.507 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -59.26 -30.51 68.34 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-O 121.112 0.482 . . . . 0.0 110.14 178.27 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.447 ' HA ' ' CE ' ' A' ' 79' ' ' LYS . 0.1 OUTLIER -86.9 -28.02 23.05 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.446 179.069 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.773 ' O ' HD12 ' A' ' 84' ' ' LEU . 92.5 mt -63.73 -48.82 75.51 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.048 -1.094 . . . . 0.0 108.048 177.596 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -60.21 -49.87 75.9 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 114.984 -1.007 . . . . 0.0 110.462 177.741 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 3.6 mtt180 -63.92 -25.51 68.18 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.476 -179.535 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 23.7 mt-30 -73.87 -45.93 47.95 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.811 0.339 . . . . 0.0 110.703 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.773 HD12 ' O ' ' A' ' 80' ' ' LEU . 0.9 OUTLIER -64.84 -28.61 69.67 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.799 179.835 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -62.38 -28.64 69.92 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.003 0.43 . . . . 0.0 110.308 179.619 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.424 ' HG3' ' N ' ' A' ' 87' ' ' LEU . 0.0 OUTLIER -72.23 -30.4 64.86 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.394 179.628 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.424 ' N ' ' HG3' ' A' ' 86' ' ' LYS . 0.2 OUTLIER -66.42 -15.72 63.54 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.166 -179.745 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -76.51 -6.78 53.29 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.403 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.442 ' N ' ' CD2' ' A' ' 89' ' ' HIS . 3.3 m170 -86.29 -38.32 17.64 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.023 0.439 . . . . 0.0 110.713 179.749 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 13.3 mttt -69.12 154.88 41.32 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.98 -179.297 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -68.72 -24.36 75.45 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.62 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -56.39 103.72 0.12 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.847 0.356 . . . . 0.0 111.067 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -157.72 144.94 18.29 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.064 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 60.78 93.42 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.88 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 10.1 ttt-85 -154.12 96.07 1.91 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.923 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -152.82 163.24 40.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.055 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -152.24 121.64 6.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.108 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 75.7 p -72.26 139.87 48.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.892 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.9 m -138.02 148.6 45.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.928 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 21.4 t -137.12 -49.86 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.193 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 6.8 mttm -64.71 164.33 12.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.874 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 22.7 m-20 -78.89 166.16 22.71 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.915 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -134.55 32.81 3.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.039 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 3.8 t30 67.57 -70.35 0.12 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.037 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 47.1 p90 -122.71 -177.63 3.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.858 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 31.0 m -133.39 143.64 38.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.03 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 61.07 109.8 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.921 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -68.03 165.52 17.79 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.895 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.408 HG23 ' O ' ' A' ' 109' ' ' VAL . 5.3 m -147.7 104.27 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.165 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -161.0 114.38 1.99 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.901 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -123.15 178.85 4.91 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.88 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.926 179.986 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.487 1.422 0 CA-C-O 120.833 0.349 . . . . 0.0 111.218 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 59.93 109.45 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.854 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -125.31 134.61 52.18 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.236 -179.708 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.62 HG12 HD12 ' A' ' 11' ' ' ILE . 9.0 tt -135.09 125.94 45.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.349 179.72 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 3.0 p -134.76 165.33 25.53 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.901 0.381 . . . . 0.0 111.446 -179.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.4 ' HB3' ' HB2' ' A' ' 40' ' ' LEU . 3.2 p -161.59 130.42 4.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.978 -0.556 . . . . 0.0 109.991 -179.388 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 15.0 mtmt -99.0 13.67 31.92 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.271 -179.601 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 11.2 tp60 -141.91 21.67 2.12 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.636 179.319 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 176.74 161.96 0.41 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.51 -179.754 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -96.62 160.28 14.47 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.21 179.39 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.62 HD12 HG12 ' A' ' 4' ' ' ILE . 3.9 mm -90.27 119.3 37.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.002 0.429 . . . . 0.0 111.202 -179.372 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.418 ' H ' HD12 ' A' ' 15' ' ' ILE . 16.8 p -100.58 157.27 34.05 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.641 179.434 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_exo -61.01 -15.08 36.74 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.477 2.118 . . . . 0.0 112.233 179.54 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -88.7 -38.72 14.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.904 0.383 . . . . 0.0 110.725 179.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.418 HD12 ' H ' ' A' ' 12' ' ' THR . 18.2 mt -73.57 -31.75 33.62 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 N-CA-C 109.484 -0.562 . . . . 0.0 109.484 179.028 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.412 ' O ' ' CB ' ' A' ' 20' ' ' ALA . 0.4 OUTLIER -72.55 -46.62 53.62 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.273 178.749 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -67.04 -33.64 75.97 Favored 'General case' 0 N--CA 1.456 -0.171 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.189 178.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.413 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 77.6 t60 -58.85 -66.22 0.54 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.995 0.426 . . . . 0.0 109.854 178.659 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.677 HG12 HD21 ' A' ' 23' ' ' LEU . 12.2 t -61.39 -44.61 98.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.796 178.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.602 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -55.15 -50.13 70.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.56 179.703 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.413 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 3.1 p30 -59.02 -28.57 66.54 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-O 120.894 0.378 . . . . 0.0 110.567 -179.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.518 ' CB ' HD13 ' A' ' 77' ' ' ILE . 13.8 mmt180 -74.09 -28.84 61.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.447 179.349 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.677 HD21 HG12 ' A' ' 19' ' ' VAL . 1.1 mt -69.7 -47.35 63.5 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.304 179.086 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.99 -27.35 66.79 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.962 179.617 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -79.34 -31.91 43.17 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.775 179.539 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.59 HD11 ' CG2' ' A' ' 77' ' ' ILE . 10.1 mt -81.07 58.27 3.42 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.863 179.817 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -121.69 2.5 10.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.637 -179.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.9 -11.57 61.04 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.755 0.312 . . . . 0.0 111.423 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.589 ' CD1' HD13 ' A' ' 84' ' ' LEU . 55.0 m95 -85.9 158.18 19.99 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.118 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.8 mm100 -102.35 66.49 0.99 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.153 0.501 . . . . 0.0 110.819 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.568 ' O ' HG23 ' A' ' 31' ' ' THR . 11.4 t -160.43 106.73 1.52 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.104 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 18.9 m-70 -62.05 93.34 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.122 -0.945 . . . . 0.0 111.59 -179.171 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.751 HD23 HG21 ' A' ' 53' ' ' ILE . 4.4 mp -48.87 153.46 0.85 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.219 178.832 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.433 HG22 ' OD1' ' A' ' 35' ' ' ASN . 6.8 mt -149.75 127.21 2.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 121.744 0.783 . . . . 0.0 112.121 -179.429 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.433 ' OD1' HG22 ' A' ' 34' ' ' ILE . 9.5 m120 65.26 50.85 0.85 Allowed Pre-proline 0 C--N 1.324 -0.517 0 CA-C-N 114.29 -1.323 . . . . 0.0 111.792 179.099 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.403 ' CD ' ' N ' ' A' ' 35' ' ' ASN . 21.7 Cg_endo -62.37 128.98 25.24 Favored 'Trans proline' 0 C--N 1.343 0.249 0 C-N-CA 121.997 1.798 . . . . 0.0 111.854 -179.46 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . 0.706 ' C ' HD12 ' A' ' 38' ' ' ILE . 19.5 t-160 -134.42 133.73 40.84 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.711 -0.396 . . . . 0.0 111.411 -179.785 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.706 HD12 ' C ' ' A' ' 37' ' ' HIS . 2.7 mp -126.17 131.09 71.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.666 179.619 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 25.1 mt -121.31 138.93 50.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.71 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.4 ' HB2' ' HB3' ' A' ' 6' ' ' SER . 10.0 mt -121.31 127.96 51.84 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.949 0.404 . . . . 0.0 110.811 179.868 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 8.5 m -125.59 -170.57 2.2 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.751 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.459 ' HA ' ' HA ' ' A' ' 47' ' ' PHE . 3.9 tttt -171.85 146.78 2.11 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.113 0.483 . . . . 0.0 110.794 -179.879 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.437 ' N ' ' HG2' ' A' ' 42' ' ' LYS . 7.2 mt-10 -131.45 169.57 13.45 Favored Pre-proline 0 C--N 1.324 -0.536 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.06 178.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . 0.426 ' HD2' ' HB3' ' A' ' 43' ' ' GLU . 69.1 Cg_exo -51.61 -19.96 8.32 Favored 'Trans proline' 0 N--CA 1.463 -0.307 0 C-N-CA 121.776 1.65 . . . . 0.0 112.23 -179.416 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -85.73 -76.71 0.32 Allowed 'General case' 0 N--CA 1.445 -0.708 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.309 179.379 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . 0.452 ' HA3' ' HA ' ' A' ' 67' ' ' GLU . . . -142.99 -156.75 6.88 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.766 -179.336 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.459 ' HA ' ' HA ' ' A' ' 42' ' ' LYS . 22.3 m-85 -108.06 150.61 26.95 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-O 121.65 0.738 . . . . 0.0 112.57 -179.302 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.574 HG13 ' HG2' ' A' ' 65' ' ' LYS . 62.2 t -124.78 140.76 47.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 114.477 -1.238 . . . . 0.0 110.405 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -132.19 124.41 28.96 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.672 -0.24 . . . . 0.0 110.715 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -120.65 147.04 45.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.62 -0.264 . . . . 0.0 110.67 -179.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.676 ' N ' HD11 ' A' ' 76' ' ' LEU . . . -145.39 142.03 28.98 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.899 0.381 . . . . 0.0 111.433 179.738 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.457 HG23 HG22 ' A' ' 61' ' ' VAL . 3.9 m -136.02 131.67 35.28 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.101 -0.5 . . . . 0.0 109.99 179.419 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.751 HG21 HD23 ' A' ' 33' ' ' LEU . 22.0 mt -132.85 137.52 53.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 121.0 0.429 . . . . 0.0 111.344 -179.637 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -105.02 128.77 53.46 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.184 179.092 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.633 ' HB ' ' HD2' ' A' ' 56' ' ' PRO . 5.7 p -124.82 166.35 20.63 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.361 -179.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.633 ' HD2' ' HB ' ' A' ' 55' ' ' THR . 56.7 Cg_endo -72.79 -4.08 14.72 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.228 1.952 . . . . 0.0 112.529 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 81.1 m-20 -117.98 -4.3 11.08 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.406 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 154.1 -171.93 32.72 Favored Glycine 0 C--N 1.332 0.333 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.699 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.513 HG13 ' O ' ' A' ' 53' ' ' ILE . 21.4 t -127.33 142.69 42.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.739 0.304 . . . . 0.0 111.093 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.536 HD21 HD11 ' A' ' 87' ' ' LEU . 30.1 mt -119.37 152.36 36.93 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.323 -0.398 . . . . 0.0 111.315 -179.69 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.457 HG22 HG23 ' A' ' 52' ' ' THR . 21.6 t -141.56 143.61 27.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.815 179.735 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.491 ' HB2' HE22 ' A' ' 83' ' ' GLN . . . -151.0 156.9 42.11 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.13 0.491 . . . . 0.0 111.545 -179.624 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 10.6 m -145.16 154.78 42.79 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.718 -179.326 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.754 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -148.91 100.78 0.21 Allowed Glycine 0 C--N 1.332 0.357 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.699 179.4 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.574 ' HG2' HG13 ' A' ' 48' ' ' VAL . 8.8 mttt -102.52 44.57 1.0 Allowed 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -178.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.62 ' ND1' HG21 ' A' ' 71' ' ' THR . 12.1 t-80 -76.36 155.3 34.23 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.78 0.324 . . . . 0.0 110.311 178.536 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.452 ' HA ' ' HA3' ' A' ' 46' ' ' GLY . 26.0 mt-10 -62.06 -26.22 68.14 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.759 0.314 . . . . 0.0 111.339 -179.871 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -97.28 121.95 39.76 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.044 0.449 . . . . 0.0 111.358 -179.395 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.6 ttt -47.51 -51.37 20.81 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.998 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 36.3 m-85 -65.91 -36.77 84.3 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.729 -179.023 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.62 HG21 ' ND1' ' A' ' 66' ' ' HIS . 94.2 m -64.23 -42.23 96.65 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.824 0.345 . . . . 0.0 110.658 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.754 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -61.51 -47.22 86.61 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.429 179.606 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.44 HG21 HG22 ' A' ' 19' ' ' VAL . 28.8 mt -59.71 -48.74 86.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.77 179.739 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 19.6 m-20 -64.03 -38.54 91.43 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.74 179.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -65.37 -45.66 83.22 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.606 179.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.676 HD11 ' N ' ' A' ' 51' ' ' ALA . 0.3 OUTLIER -54.22 -56.28 19.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.541 -0.3 . . . . 0.0 110.418 179.425 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.59 ' CG2' HD11 ' A' ' 26' ' ' LEU . 52.3 mt -57.86 -33.21 45.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 N-CA-C 110.227 -0.286 . . . . 0.0 110.227 179.231 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -58.63 -35.52 72.64 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.545 0.688 . . . . 0.0 109.781 178.641 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.4 mptp? -76.81 -27.77 55.31 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 114.83 -1.077 . . . . 0.0 110.138 179.409 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.509 HD12 ' HA ' ' A' ' 77' ' ' ILE . 96.3 mt -62.05 -50.14 73.19 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 177.472 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.462 ' HA ' HD12 ' A' ' 84' ' ' LEU . 2.5 tt0 -62.79 -46.25 88.86 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 114.277 -1.329 . . . . 0.0 110.709 177.869 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.69 -34.14 75.23 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.07 -179.588 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.491 HE22 ' HB2' ' A' ' 62' ' ' ALA . 36.9 mt-30 -75.39 -36.08 60.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.586 179.713 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.637 ' HA ' HD12 ' A' ' 87' ' ' LEU . 4.3 mt -64.66 -27.68 69.09 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.83 179.869 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -64.17 -26.02 68.34 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.729 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.463 ' HA ' ' CE1' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -72.71 -32.38 65.7 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.215 0.531 . . . . 0.0 110.85 -179.971 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.637 HD12 ' HA ' ' A' ' 84' ' ' LEU . 5.0 mt -68.23 -8.5 39.69 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.373 -0.83 . . . . 0.0 112.055 -179.394 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -74.87 -41.91 58.89 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.107 0.479 . . . . 0.0 111.103 -179.717 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.463 ' CE1' ' HA ' ' A' ' 86' ' ' LYS . 2.4 p-80 -85.17 -174.65 5.36 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.936 179.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.461 ' CB ' ' O ' ' A' ' 89' ' ' HIS . 11.9 tttt 86.28 146.4 0.06 Allowed 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.796 -179.756 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 141.25 109.9 0.8 Allowed Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.406 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -95.49 21.7 7.88 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.653 0.264 . . . . 0.0 111.198 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . 53.3 80.48 0.1 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.32 179.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -175.92 37.11 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.88 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 28.1 mtp85 -96.48 -32.76 12.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.922 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -95.92 80.28 3.32 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.098 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -82.84 -177.1 6.62 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.091 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -117.4 143.63 45.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.882 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.16 175.81 3.62 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.866 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.412 HG23 ' N ' ' A' ' 101' ' ' LYS . 4.2 m -131.31 -49.82 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.16 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.412 ' N ' HG23 ' A' ' 100' ' ' VAL . 3.0 tptt 179.94 38.93 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.831 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -144.41 117.08 8.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.902 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -173.97 87.08 0.05 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.062 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 31.9 m120 -119.55 -48.76 2.38 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.958 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 14.5 t80 -118.19 94.14 4.39 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.939 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 21.3 t -123.53 -60.53 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.093 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 60.71 110.17 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.888 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -122.2 -47.77 2.13 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.898 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 21.4 t -76.4 128.22 37.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.182 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -127.37 -68.12 0.8 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.863 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -150.88 92.45 1.83 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.91 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.243 -0.884 . . . . 0.0 110.929 179.958 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 1.2 m . . . . . 0 N--CA 1.486 1.36 0 CA-C-O 120.765 0.317 . . . . 0.0 111.213 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . 0.688 ' HG3' HD11 ' A' ' 23' ' ' LEU . 5.9 tmm? -59.93 115.55 3.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.827 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -124.0 107.15 11.0 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.369 -179.704 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 40.0 mt -109.09 126.14 66.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.619 179.546 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -133.99 162.01 33.23 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.922 0.391 . . . . 0.0 111.147 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.422 ' HB3' ' HB2' ' A' ' 40' ' ' LEU . 21.6 p -162.72 137.58 6.69 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.298 -179.586 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.4 mmtt -101.82 34.65 2.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.116 -179.569 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -141.96 -45.3 0.34 Allowed 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.942 179.711 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.41 -177.81 4.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.84 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -106.8 163.95 12.51 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.435 179.817 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 3.8 mm -90.32 118.07 34.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 121.037 0.446 . . . . 0.0 111.009 -179.557 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.401 ' HB ' ' HD2' ' A' ' 13' ' ' PRO . 16.1 p -100.84 153.99 37.42 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.854 179.648 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.401 ' HD2' ' HB ' ' A' ' 12' ' ' THR . 15.2 Cg_endo -57.37 -27.33 75.15 Favored 'Trans proline' 0 C--N 1.343 0.289 0 C-N-CA 122.417 2.078 . . . . 0.0 111.904 179.306 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -74.82 -40.41 61.08 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.934 0.397 . . . . 0.0 110.518 179.665 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 26.0 mt -73.14 -31.05 33.28 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 178.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.92 -46.24 58.36 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.399 178.73 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -67.61 -35.15 78.4 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.306 178.89 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.44 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 52.6 t60 -58.29 -63.56 1.22 Allowed 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 178.671 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.641 HG12 HD21 ' A' ' 23' ' ' LEU . 28.6 t -61.41 -42.9 95.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.528 -0.305 . . . . 0.0 110.258 178.58 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.646 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -56.62 -46.13 81.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.46 179.401 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.44 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 1.2 p30 -60.02 -31.88 70.36 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 120.923 0.392 . . . . 0.0 110.546 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 36.1 mmt180 -73.23 -27.11 61.41 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.613 179.66 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.688 HD11 ' HG3' ' A' ' 2' ' ' MET . 2.0 mt -68.78 -49.82 55.47 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.118 0.485 . . . . 0.0 109.994 178.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.21 -26.42 66.36 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.016 179.459 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 19.8 tttt -77.22 -32.74 56.1 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.726 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.749 HD11 ' CG2' ' A' ' 77' ' ' ILE . 5.1 mt -80.73 53.84 1.99 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.845 0.355 . . . . 0.0 110.623 179.234 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -111.71 -11.14 14.02 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.083 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.96 -17.38 24.15 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.891 0.377 . . . . 0.0 111.058 179.742 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.915 ' CG ' HD13 ' A' ' 84' ' ' LEU . 63.2 m95 -84.03 -159.18 0.37 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.885 -179.74 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -133.6 -103.18 0.25 Allowed 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 178.783 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.418 ' O ' ' HB2' ' A' ' 32' ' ' HIS . 0.0 OUTLIER -83.39 -166.21 1.31 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.951 0.405 . . . . 0.0 111.263 179.504 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . 0.591 ' NE2' HD21 ' A' ' 87' ' ' LEU . 0.4 OUTLIER 73.32 51.75 0.13 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.822 179.42 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.456 HD23 ' HA ' ' A' ' 33' ' ' LEU . 13.4 mt -162.68 100.48 1.02 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.66 178.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.715 HG22 ' OD1' ' A' ' 35' ' ' ASN . 8.8 mt -151.98 124.58 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 121.386 0.612 . . . . 0.0 111.669 -179.867 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.715 ' OD1' HG22 ' A' ' 34' ' ' ILE . 1.8 m-20 68.56 67.91 0.49 Allowed Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.15 179.564 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -74.14 133.75 18.41 Favored 'Trans proline' 0 N--CA 1.463 -0.268 0 C-N-CA 122.172 1.915 . . . . 0.0 112.279 -179.426 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . 0.665 ' C ' HD12 ' A' ' 38' ' ' ILE . 2.1 t-160 -133.95 133.71 41.7 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 121.053 -0.259 . . . . 0.0 110.492 179.634 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.665 HD12 ' C ' ' A' ' 37' ' ' HIS . 3.1 mp -129.43 129.52 67.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.895 0.379 . . . . 0.0 111.155 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.572 ' C ' HD22 ' A' ' 40' ' ' LEU . 3.9 mp -118.09 140.47 41.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.404 179.511 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.572 HD22 ' C ' ' A' ' 39' ' ' ILE . 3.5 mm? -117.91 126.66 52.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.951 0.405 . . . . 0.0 111.161 -179.636 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -123.68 -172.88 2.62 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.379 179.638 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.456 ' CE ' ' CE2' ' A' ' 47' ' ' PHE . 13.4 tttm -172.95 146.73 1.56 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.197 0.522 . . . . 0.0 111.003 -179.803 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.427 ' HB3' ' HD2' ' A' ' 44' ' ' PRO . 43.7 mt-10 -132.33 166.79 26.12 Favored Pre-proline 0 C--N 1.323 -0.583 0 CA-C-N 115.428 -0.805 . . . . 0.0 109.153 179.054 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . 0.427 ' HD2' ' HB3' ' A' ' 43' ' ' GLU . 73.7 Cg_exo -50.05 -19.75 4.45 Favored 'Trans proline' 0 N--CA 1.464 -0.236 0 C-N-CA 121.678 1.586 . . . . 0.0 112.365 -179.529 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.75 -76.25 0.34 Allowed 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 115.575 -0.738 . . . . 0.0 110.328 179.317 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . 0.452 ' HA3' ' HA ' ' A' ' 67' ' ' GLU . . . -142.72 -158.74 7.66 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.751 -179.301 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.456 ' CE2' ' CE ' ' A' ' 42' ' ' LYS . 24.2 m-85 -107.35 151.19 25.83 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 121.577 0.703 . . . . 0.0 112.433 -179.298 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.59 HG22 ' CB ' ' A' ' 65' ' ' LYS . 78.7 t -126.0 139.78 50.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 114.712 -1.131 . . . . 0.0 110.577 -179.881 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.443 ' O ' ' HA ' ' A' ' 63' ' ' SER . . . -131.03 124.44 30.88 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.642 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -120.07 148.66 43.31 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.694 0.283 . . . . 0.0 110.737 -179.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.802 ' CB ' HD11 ' A' ' 76' ' ' LEU . . . -145.11 142.08 29.36 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.976 0.417 . . . . 0.0 111.399 179.925 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 4.0 m -133.84 132.03 39.92 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.78 179.466 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.588 ' O ' HG13 ' A' ' 59' ' ' VAL . 13.2 mt -133.81 136.78 53.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.996 0.426 . . . . 0.0 111.516 -179.377 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.4 ' O ' ' HB ' ' A' ' 34' ' ' ILE . 3.3 m-80 -100.83 144.32 29.93 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.54 179.011 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.46 ' HB ' ' HA ' ' A' ' 32' ' ' HIS . 24.4 p -136.3 168.68 16.08 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.735 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.461 ' HG3' HD11 ' A' ' 34' ' ' ILE . 10.4 Cg_exo -71.84 -12.98 29.15 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.843 2.362 . . . . 0.0 112.705 -179.858 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -130.15 21.36 5.3 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 112.038 0.384 . . . . 0.0 112.038 -179.368 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 150.52 -164.79 29.9 Favored Glycine 0 C--N 1.33 0.223 0 C-N-CA 120.082 -1.056 . . . . 0.0 113.334 179.682 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.588 HG13 ' O ' ' A' ' 53' ' ' ILE . 12.8 t -141.7 146.55 22.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.687 0.279 . . . . 0.0 110.921 -179.868 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.568 HD22 ' HB3' ' A' ' 83' ' ' GLN . 2.8 mt -119.11 147.44 44.16 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.871 0.367 . . . . 0.0 111.271 -179.679 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 9.2 p -141.18 147.37 22.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.018 179.898 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.616 ' O ' HD12 ' A' ' 76' ' ' LEU . . . -155.23 154.41 32.15 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.078 0.466 . . . . 0.0 111.333 -179.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.443 ' HA ' ' O ' ' A' ' 49' ' ' ALA . 3.1 p -146.56 153.99 41.0 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.737 -179.41 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.755 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -147.47 107.03 0.37 Allowed Glycine 0 C--N 1.333 0.386 0 N-CA-C 111.496 -0.642 . . . . 0.0 111.496 179.199 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.59 ' CB ' HG22 ' A' ' 48' ' ' VAL . 13.6 mtpt -107.24 44.75 1.04 Allowed 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 -178.701 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.617 ' ND1' HG21 ' A' ' 71' ' ' THR . 12.8 t-80 -76.77 155.65 32.97 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.81 0.338 . . . . 0.0 110.292 178.688 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.452 ' HA ' ' HA3' ' A' ' 46' ' ' GLY . 1.3 mm-40 -61.64 -26.29 67.91 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.823 0.344 . . . . 0.0 111.185 179.819 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -98.09 123.69 42.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.367 -179.558 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 6.1 ttt -47.63 -47.43 29.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.773 -0.648 . . . . 0.0 111.796 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -66.46 -38.71 87.95 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.861 -179.016 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.617 HG21 ' ND1' ' A' ' 66' ' ' HIS . 87.8 m -63.84 -42.01 97.69 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.707 0.289 . . . . 0.0 110.76 -179.749 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.755 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -61.64 -49.0 78.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.541 179.678 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.525 HG21 HG22 ' A' ' 19' ' ' VAL . 23.1 mt -59.91 -47.54 91.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.788 179.715 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -63.39 -37.74 88.44 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.604 179.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -65.64 -44.1 87.46 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.575 179.57 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.802 HD11 ' CB ' ' A' ' 51' ' ' ALA . 0.3 OUTLIER -54.49 -56.8 15.1 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.269 179.323 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.749 ' CG2' HD11 ' A' ' 26' ' ' LEU . 14.1 mm -57.66 -30.31 36.78 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.493 -0.322 . . . . 0.0 110.133 179.044 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -58.32 -36.32 73.2 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.474 0.654 . . . . 0.0 109.694 178.534 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.6 ' HB2' ' HB1' ' A' ' 62' ' ' ALA . 5.7 mmtm -76.29 -30.06 57.61 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.853 -1.067 . . . . 0.0 110.375 179.365 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.559 HD22 HD12 ' A' ' 53' ' ' ILE . 31.4 mt -60.33 -49.68 76.62 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 177.477 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -61.44 -43.16 99.36 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 114.207 -1.361 . . . . 0.0 110.091 177.278 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.42 -30.6 71.34 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.55 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.568 ' HB3' HD22 ' A' ' 60' ' ' LEU . 34.2 mt-30 -76.35 -40.21 51.85 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.015 0.436 . . . . 0.0 110.48 179.486 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.915 HD13 ' CG ' ' A' ' 29' ' ' TRP . 6.5 mt -64.98 -30.76 71.77 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.646 179.684 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 -64.3 -52.66 57.45 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.551 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.437 ' HA ' ' CE1' ' A' ' 89' ' ' HIS . 6.9 mmtm -71.41 -21.17 62.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.48 179.52 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.592 HD13 ' C ' ' A' ' 87' ' ' LEU . 2.3 tm? -69.77 -30.72 68.36 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.644 179.701 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -76.13 -12.88 60.19 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.555 -179.746 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.437 ' CE1' ' HA ' ' A' ' 86' ' ' LYS . 6.7 m170 -85.17 -55.54 3.99 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.861 0.363 . . . . 0.0 110.959 179.812 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -70.34 65.76 0.29 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.947 -179.726 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 146.54 119.08 1.15 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.72 -0.753 . . . . 0.0 112.395 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -87.77 54.19 3.03 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.884 0.373 . . . . 0.0 111.0 -179.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . 59.72 168.92 0.07 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.27 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 8.1 ttt180 -103.03 160.76 14.34 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.86 179.899 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 1.1 tpt180 -102.88 -179.86 4.08 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.853 -179.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -72.99 -32.8 65.4 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.046 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -159.36 -45.07 0.05 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.131 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 60.55 167.54 0.08 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.832 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 4.8 t 60.94 -177.32 0.11 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.881 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.423 HG22 ' N ' ' A' ' 101' ' ' LYS . 9.4 p -131.59 154.7 40.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.085 179.92 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.423 ' N ' HG22 ' A' ' 100' ' ' VAL . 7.3 mttp -97.88 -48.35 5.21 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.811 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -139.33 -65.36 0.48 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.914 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -171.74 -55.34 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.019 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 -154.07 -64.86 0.14 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.951 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -68.96 105.62 2.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.889 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.529 ' O ' HG23 ' A' ' 106' ' ' VAL . 27.2 m -104.62 115.35 46.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.195 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -117.95 169.68 9.45 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.845 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -135.59 -47.34 0.68 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.866 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 30.1 t -126.04 143.27 40.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.055 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -117.96 98.36 6.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.817 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -103.49 130.08 50.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.884 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.168 -0.92 . . . . 0.0 110.908 179.982 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 1.3 p . . . . . 0 N--CA 1.485 1.317 0 CA-C-O 120.82 0.343 . . . . 0.0 111.087 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . 0.859 ' HE1' HD11 ' A' ' 4' ' ' ILE . 8.4 tmm? -66.24 110.79 3.16 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.886 -179.87 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -103.0 124.87 49.33 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.19 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.859 HD11 ' HE1' ' A' ' 2' ' ' MET . 34.5 mt -109.89 124.01 66.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.873 179.786 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.8 p -134.09 156.7 47.81 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.059 179.741 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 22.0 p -164.37 139.79 5.89 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.614 -179.754 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 6.2 mtmp? -101.55 35.5 2.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.809 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -141.94 -50.23 0.39 Allowed 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.755 179.823 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 17.5 mtm -119.01 177.9 4.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.857 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 -104.52 164.96 11.38 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.736 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.482 HG22 ' HG3' ' A' ' 16' ' ' ARG . 4.8 mm -90.02 112.35 24.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 121.088 0.471 . . . . 0.0 111.009 -179.678 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.41 ' H ' HD12 ' A' ' 15' ' ' ILE . 19.3 p -98.92 148.69 34.91 Favored Pre-proline 0 C--N 1.326 -0.419 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.018 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_exo -55.3 -21.06 27.53 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.325 2.017 . . . . 0.0 111.69 179.148 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -76.12 -42.81 45.82 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.051 0.453 . . . . 0.0 110.317 179.255 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.622 ' O ' HG23 ' A' ' 19' ' ' VAL . 24.6 mt -72.41 -29.02 29.92 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.34 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.489 178.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.482 ' HG3' HG22 ' A' ' 11' ' ' ILE . 79.4 mtt180 -74.67 -45.19 46.19 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.575 -0.739 . . . . 0.0 109.74 178.773 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 3.3 tm0? -67.38 -38.89 85.44 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.564 179.022 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.487 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 78.3 t60 -59.75 -60.58 3.61 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 178.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.622 HG23 ' O ' ' A' ' 15' ' ' ILE . 15.1 t -60.45 -46.94 94.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 C-N-CA 121.014 -0.274 . . . . 0.0 110.31 178.733 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.69 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -58.1 -41.58 83.81 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.887 179.7 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.487 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 0.9 OUTLIER -59.59 -34.37 72.64 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.006 0.431 . . . . 0.0 110.064 179.9 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 9.0 mmt180 -74.81 -25.98 59.41 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.747 179.551 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.69 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 10.1 mt -68.85 -57.41 5.59 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.285 0.564 . . . . 0.0 110.521 179.388 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.15 -25.76 65.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.291 -0.868 . . . . 0.0 111.566 -179.777 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 10.1 tppt? -78.64 -32.57 47.37 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.039 0.447 . . . . 0.0 110.29 179.674 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.466 ' CD2' ' CD1' ' A' ' 29' ' ' TRP . 44.4 mt -80.15 63.81 4.77 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.836 -179.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -64.8 -42.44 95.02 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.959 -179.534 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.428 ' HG2' ' NE1' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -89.02 39.61 0.94 Allowed 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 120.839 0.352 . . . . 0.0 111.592 -179.472 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.644 ' HB3' HD13 ' A' ' 84' ' ' LEU . 27.1 m95 -148.26 -77.77 0.16 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.763 -179.242 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.517 ' NE2' HD22 ' A' ' 23' ' ' LEU . 18.5 mt-30 -65.22 102.27 0.63 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.708 0.289 . . . . 0.0 110.58 -179.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -159.01 -43.9 0.06 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.976 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -94.17 28.56 2.45 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.849 179.771 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.994 HD22 HG21 ' A' ' 53' ' ' ILE . 35.3 mt -102.99 156.43 17.68 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.422 179.743 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 28.9 mt -140.34 95.81 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 120.803 0.335 . . . . 0.0 111.498 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 59.74 70.15 1.12 Allowed Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.272 179.746 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.514 ' HB3' HG23 ' A' ' 53' ' ' ILE . 72.4 Cg_endo -73.9 163.83 36.05 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.557 2.171 . . . . 0.0 111.896 179.463 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . 0.497 ' O ' HD13 ' A' ' 38' ' ' ILE . 1.5 t-160 -137.36 131.11 31.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.043 0.449 . . . . 0.0 111.369 -179.596 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.709 HD12 ' CB ' ' A' ' 51' ' ' ALA . 8.5 mm -121.0 134.31 64.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.703 179.766 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.42 ' O ' HD23 ' A' ' 40' ' ' LEU . 23.3 mt -120.85 142.27 37.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.026 -179.853 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.42 HD23 ' O ' ' A' ' 39' ' ' ILE . 10.3 mt -121.29 128.31 52.21 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.78 -179.973 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.3 m -124.65 -171.53 2.37 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.492 179.813 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.408 ' HG3' ' CD2' ' A' ' 47' ' ' PHE . 7.5 ttpp -160.41 141.18 11.88 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.339 0.59 . . . . 0.0 111.353 -179.739 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -131.49 157.47 78.04 Favored Pre-proline 0 C--N 1.322 -0.593 0 CA-C-N 115.089 -0.959 . . . . 0.0 109.27 179.25 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_exo -52.41 -24.49 21.8 Favored 'Trans proline' 0 N--CA 1.464 -0.235 0 C-N-CA 121.808 1.672 . . . . 0.0 112.371 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -89.48 -6.83 56.1 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.433 -0.803 . . . . 0.0 112.766 -179.081 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 150.12 -163.87 29.55 Favored Glycine 0 C--O 1.224 -0.493 0 C-N-CA 120.239 -0.982 . . . . 0.0 112.16 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.408 ' CD2' ' HG3' ' A' ' 42' ' ' LYS . 18.7 m-85 -109.19 154.02 22.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.529 0.68 . . . . 0.0 111.959 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.563 HG22 ' CB ' ' A' ' 65' ' ' LYS . 74.6 t -127.72 139.73 51.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 114.858 -1.065 . . . . 0.0 111.042 -179.204 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -130.94 122.83 27.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.38 179.481 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -118.64 149.48 41.32 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.709 0.29 . . . . 0.0 110.807 -179.813 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.709 ' CB ' HD12 ' A' ' 38' ' ' ILE . . . -144.31 139.38 28.52 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.234 179.787 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.7 m -133.78 131.44 39.33 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 179.393 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.994 HG21 HD22 ' A' ' 33' ' ' LEU . 19.0 mt -133.05 136.6 55.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 121.146 0.498 . . . . 0.0 111.729 -179.226 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -101.79 119.06 38.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.688 179.38 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.728 HG22 HD23 ' A' ' 33' ' ' LEU . 9.3 p -112.46 155.89 43.06 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.529 179.717 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -63.01 -14.08 39.24 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.521 2.148 . . . . 0.0 112.576 -179.806 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 61.8 m-80 -120.38 22.23 11.38 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 111.709 0.262 . . . . 0.0 111.709 -179.605 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 139.33 -167.14 25.32 Favored Glycine 0 N--CA 1.453 -0.212 0 C-N-CA 120.446 -0.883 . . . . 0.0 112.85 179.707 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.706 HG13 ' O ' ' A' ' 53' ' ' ILE . 16.6 t -137.59 142.33 36.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.82 0.343 . . . . 0.0 111.04 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.598 HD12 ' C ' ' A' ' 59' ' ' VAL . 7.6 mp -116.34 153.54 31.81 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.104 -179.84 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 21.6 t -140.26 147.15 23.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.067 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -153.77 151.69 29.86 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.023 0.439 . . . . 0.0 111.576 -179.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -145.18 155.24 43.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.664 -179.342 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.698 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -148.67 104.53 0.28 Allowed Glycine 0 C--N 1.333 0.367 0 N-CA-C 111.399 -0.681 . . . . 0.0 111.399 179.32 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.563 ' CB ' HG22 ' A' ' 48' ' ' VAL . 10.7 mttm -106.87 45.5 0.98 Allowed 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -178.604 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.535 ' ND1' HG21 ' A' ' 71' ' ' THR . 14.6 t-80 -75.47 156.26 35.4 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 178.474 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -59.97 -27.56 66.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.752 0.311 . . . . 0.0 111.218 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -97.97 119.89 37.41 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.985 0.421 . . . . 0.0 111.475 -179.343 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.437 ' HE1' HD13 ' A' ' 15' ' ' ILE . 1.2 ttt -47.73 -46.27 29.71 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.502 179.732 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 45.6 m-85 -66.57 -39.51 88.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.127 -179.556 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.535 HG21 ' ND1' ' A' ' 66' ' ' HIS . 92.4 m -65.42 -38.56 90.27 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.668 179.87 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.698 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -62.03 -50.64 71.23 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.825 179.772 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.459 HG21 HG22 ' A' ' 19' ' ' VAL . 7.3 mt -61.34 -42.01 92.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.698 0.285 . . . . 0.0 110.249 179.518 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -64.53 -40.74 96.17 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.13 0.491 . . . . 0.0 109.965 178.862 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -65.41 -44.58 87.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.57 179.438 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.607 HD11 ' N ' ' A' ' 51' ' ' ALA . 0.3 OUTLIER -52.38 -59.91 3.85 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 179.119 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.573 HD13 HD12 ' A' ' 80' ' ' LEU . 1.9 mm -55.92 -28.7 24.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 178.503 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.52 -41.69 90.55 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.395 0.617 . . . . 0.0 109.433 178.243 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.32 -30.87 65.17 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.987 -1.006 . . . . 0.0 110.191 178.898 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.624 ' O ' HD12 ' A' ' 84' ' ' LEU . 96.9 mt -62.74 -46.51 87.72 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 177.43 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.27 -45.7 92.4 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 114.674 -1.148 . . . . 0.0 110.253 177.556 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.97 -35.71 81.59 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.529 -179.528 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -73.65 -46.87 44.08 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.893 0.378 . . . . 0.0 110.361 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.644 HD13 ' HB3' ' A' ' 29' ' ' TRP . 1.5 mt -64.69 -27.67 69.08 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.405 179.387 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.433 ' O ' ' HG3' ' A' ' 88' ' ' GLN . 54.7 t30 -61.15 -46.98 88.32 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.151 -179.575 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.455 ' O ' ' CD2' ' A' ' 89' ' ' HIS . 5.4 mtmm -75.7 -24.04 56.2 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.976 179.649 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.802 ' O ' HD23 ' A' ' 87' ' ' LEU . 3.2 tt -72.38 -12.84 61.29 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.161 -0.472 . . . . 0.0 112.092 -179.394 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.433 ' HG3' ' O ' ' A' ' 85' ' ' ASN . 2.7 pp0? -76.02 -45.2 35.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.921 0.391 . . . . 0.0 111.925 -179.088 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.455 ' CD2' ' O ' ' A' ' 86' ' ' LYS . 1.6 p-80 -87.85 164.43 15.9 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.234 -179.913 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -170.33 -43.87 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.95 179.652 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 171.03 -162.76 35.69 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.451 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 60.98 95.92 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.847 0.356 . . . . 0.0 110.929 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . 62.65 122.49 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.122 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 12.8 ptp180 -59.79 -31.99 70.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.87 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -69.88 131.36 44.32 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.806 -179.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -67.17 113.39 5.08 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.193 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -78.48 153.62 31.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.109 -179.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . 0.419 HG22 ' N ' ' A' ' 99' ' ' SER . 18.7 m 60.33 163.06 0.06 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.903 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . 0.419 ' N ' HG22 ' A' ' 98' ' ' THR . 0.3 OUTLIER 60.39 -173.41 0.12 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.916 -179.95 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 21.5 t 63.15 146.65 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.156 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 1.3 mtpt -155.91 173.55 16.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.945 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -126.25 89.26 2.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.884 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -69.11 -176.37 0.88 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.131 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 21.0 t30 60.44 168.02 0.08 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.905 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 36.4 p90 -110.71 118.29 35.77 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.896 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.436 HG22 ' N ' ' A' ' 107' ' ' GLU . 9.8 p -124.99 155.73 33.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.056 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . 0.436 ' N ' HG22 ' A' ' 106' ' ' VAL . 0.0 OUTLIER -69.31 124.47 23.93 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.872 179.891 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -152.18 35.99 0.53 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.842 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.556 HG13 ' O ' ' A' ' 109' ' ' VAL . 11.4 p -124.3 114.23 40.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.087 179.981 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -110.73 153.19 25.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.879 -179.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 27.3 mt-10 -104.48 176.63 5.09 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.882 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.294 -0.86 . . . . 0.0 110.865 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.487 1.402 0 CA-C-O 120.856 0.36 . . . . 0.0 111.193 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . 0.769 ' HG3' HD11 ' A' ' 23' ' ' LEU . 6.1 tmm? -55.42 121.07 8.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.909 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -120.34 124.38 45.41 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.165 -179.863 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 49.2 mt -120.39 125.95 74.72 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.849 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -132.87 160.66 36.33 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.986 179.729 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.405 ' HB3' ' HB2' ' A' ' 40' ' ' LEU . 21.9 p -163.35 142.02 8.14 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.745 -179.468 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.7 mmtm -103.92 16.15 26.98 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.353 -179.795 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 17.6 mt-30 -141.92 23.02 2.09 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 120.791 0.329 . . . . 0.0 111.031 179.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 176.46 -178.26 0.15 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.654 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -121.12 163.04 19.02 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.784 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 3.8 mm -91.18 118.19 35.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.937 0.398 . . . . 0.0 110.877 -179.748 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.493 ' H ' HD12 ' A' ' 15' ' ' ILE . 19.2 p -100.21 159.26 30.27 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.871 179.739 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.431 ' HA ' ' HG2' ' A' ' 16' ' ' ARG . 24.1 Cg_exo -62.58 -13.3 32.73 Favored 'Trans proline' 0 C--N 1.344 0.291 0 C-N-CA 122.611 2.207 . . . . 0.0 112.215 179.479 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -90.23 -38.59 13.33 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.025 0.441 . . . . 0.0 110.678 179.537 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.493 HD12 ' H ' ' A' ' 12' ' ' THR . 19.3 mt -72.89 -32.38 39.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.758 -0.656 . . . . 0.0 109.513 179.194 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.431 ' HG2' ' HA ' ' A' ' 13' ' ' PRO . 23.2 ptt180 -71.54 -45.73 61.53 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.538 178.86 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.41 ' N ' ' CG ' ' A' ' 16' ' ' ARG . 6.0 tp-100 -67.02 -35.85 80.82 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.492 179.014 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.453 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 68.0 t60 -58.3 -64.03 1.06 Allowed 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 178.682 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.946 HG13 HD11 ' A' ' 77' ' ' ILE . 15.2 t -61.43 -45.32 98.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.663 178.866 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.633 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -55.52 -49.28 73.04 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.678 179.751 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.453 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 3.0 p30 -59.13 -29.24 67.26 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.822 0.344 . . . . 0.0 110.641 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 41.8 mmt180 -74.77 -28.03 60.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.528 179.339 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.769 HD11 ' HG3' ' A' ' 2' ' ' MET . 1.3 mt -68.85 -48.55 63.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.964 0.412 . . . . 0.0 110.102 178.794 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.97 -26.25 65.86 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.793 179.473 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 15.6 tttp -78.51 -32.04 47.89 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.649 179.492 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.642 HD23 ' OE2' ' A' ' 81' ' ' GLU . 5.4 mt -80.31 57.13 2.69 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.713 179.695 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -103.25 -3.24 25.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.515 -179.811 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.412 ' HE3' ' CZ2' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -66.71 -14.11 62.13 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.84 0.353 . . . . 0.0 111.28 179.925 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.589 ' NE1' HD13 ' A' ' 84' ' ' LEU . 49.8 m95 -84.96 -51.9 6.37 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.019 0.437 . . . . 0.0 110.895 179.882 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 66.99 73.36 0.35 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.133 179.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 9.1 t -160.06 149.69 17.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.168 0.509 . . . . 0.0 111.009 179.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . 0.556 ' O ' HD23 ' A' ' 33' ' ' LEU . 43.3 m-70 -53.22 160.61 1.05 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.484 -0.78 . . . . 0.0 112.321 -178.792 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.997 HD22 HG21 ' A' ' 53' ' ' ILE . 72.0 mt -155.4 49.86 0.55 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.07 -0.968 . . . . 0.0 109.357 179.564 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 2.9 mt -46.62 92.44 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 121.997 0.903 . . . . 0.0 112.783 -178.567 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 51.44 84.72 0.2 Allowed Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 113.795 -1.548 . . . . 0.0 113.8 177.556 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.725 ' HB3' HG23 ' A' ' 53' ' ' ILE . 94.5 Cg_endo -86.3 132.5 3.76 Favored 'Trans proline' 0 N--CA 1.454 -0.847 0 C-N-CA 122.686 2.257 . . . . 0.0 109.92 177.11 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . 0.568 ' C ' HD13 ' A' ' 38' ' ' ILE . 0.5 OUTLIER -98.63 130.47 45.15 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -177.877 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.626 HD12 ' HB1' ' A' ' 51' ' ' ALA . 5.5 mm -121.48 132.65 70.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.342 -0.844 . . . . 0.0 109.766 178.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 26.6 mt -119.96 148.08 23.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 121.0 0.428 . . . . 0.0 111.868 -179.232 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.405 ' HB2' ' HB3' ' A' ' 6' ' ' SER . 4.6 mt -123.38 127.18 48.1 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.629 179.59 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -124.8 -170.76 2.22 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.725 -179.889 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.459 ' HA ' ' HA ' ' A' ' 47' ' ' PHE . 1.6 tttp -170.5 145.05 2.53 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.304 0.574 . . . . 0.0 110.932 -179.786 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.456 ' N ' ' HG2' ' A' ' 42' ' ' LYS . 3.3 mm-40 -130.24 163.87 44.88 Favored Pre-proline 0 C--N 1.323 -0.576 0 CA-C-N 115.457 -0.792 . . . . 0.0 108.927 178.871 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . 0.422 ' HD2' ' HB3' ' A' ' 43' ' ' GLU . 5.0 Cg_endo -48.14 -21.96 3.32 Favored 'Trans proline' 0 N--CA 1.463 -0.287 0 C-N-CA 122.073 1.848 . . . . 0.0 112.166 -179.359 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -83.73 -75.15 0.34 Allowed 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.212 179.291 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . 0.469 ' HA3' ' HA ' ' A' ' 67' ' ' GLU . . . -143.89 -156.67 6.88 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.814 -179.31 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.459 ' HA ' ' HA ' ' A' ' 42' ' ' LYS . 22.8 m-85 -107.69 151.38 25.75 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.654 0.74 . . . . 0.0 112.476 -179.32 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.545 HG13 ' HG2' ' A' ' 65' ' ' LYS . 78.6 t -124.46 140.93 46.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 114.525 -1.216 . . . . 0.0 110.424 -179.875 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.439 ' O ' ' HA ' ' A' ' 63' ' ' SER . . . -132.08 125.1 30.55 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.64 -0.255 . . . . 0.0 110.922 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 -117.77 148.58 41.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.465 179.652 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.728 ' HB2' HD21 ' A' ' 76' ' ' LEU . . . -144.58 142.52 30.23 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.968 0.413 . . . . 0.0 111.771 -179.802 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.1 m -135.26 131.32 36.45 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.839 179.334 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.997 HG21 HD22 ' A' ' 33' ' ' LEU . 21.3 mt -133.35 138.84 50.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.119 0.485 . . . . 0.0 111.842 -179.159 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 18.9 m120 -102.28 119.18 38.37 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.648 179.3 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.501 ' HB ' ' HD2' ' A' ' 56' ' ' PRO . 6.1 p -113.82 162.35 23.14 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.295 179.673 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.501 ' HD2' ' HB ' ' A' ' 55' ' ' THR . 68.9 Cg_endo -76.22 -3.17 13.49 Favored 'Trans proline' 0 N--CA 1.463 -0.318 0 C-N-CA 122.211 1.94 . . . . 0.0 112.517 -179.857 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -129.63 23.47 5.44 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.202 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 140.4 -167.4 25.52 Favored Glycine 0 C--N 1.33 0.239 0 C-N-CA 120.54 -0.838 . . . . 0.0 112.778 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 21.3 t -131.55 147.27 32.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 120.766 0.317 . . . . 0.0 111.11 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 13.0 mt -120.65 141.97 49.87 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.29 -179.767 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 21.7 t -141.21 139.96 32.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.758 179.74 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.539 ' HB1' ' HB2' ' A' ' 79' ' ' LYS . . . -151.42 159.5 44.2 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.296 0.569 . . . . 0.0 111.857 -179.557 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.439 ' HA ' ' O ' ' A' ' 49' ' ' ALA . 2.4 p -145.58 154.89 42.66 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.281 -0.872 . . . . 0.0 111.678 -179.306 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.715 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -148.31 105.05 0.3 Allowed Glycine 0 C--N 1.332 0.358 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.551 179.341 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.545 ' HG2' HG13 ' A' ' 48' ' ' VAL . 5.3 mttp -105.97 44.9 1.0 Allowed 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 112.401 0.519 . . . . 0.0 112.401 -178.683 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.634 ' ND1' HG21 ' A' ' 71' ' ' THR . 12.6 t-80 -76.64 155.69 33.26 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.757 0.313 . . . . 0.0 110.309 178.582 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.469 ' HA ' ' HA3' ' A' ' 46' ' ' GLY . 10.8 mt-10 -61.63 -26.34 67.94 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.787 0.327 . . . . 0.0 111.223 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -97.61 122.63 40.91 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.083 0.468 . . . . 0.0 111.475 -179.364 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.565 ' HE3' HD11 ' A' ' 73' ' ' ILE . 0.9 OUTLIER -47.71 -49.91 26.59 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.772 179.955 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 40.3 m-85 -66.19 -37.45 85.63 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.711 -179.087 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.634 HG21 ' ND1' ' A' ' 66' ' ' HIS . 94.1 m -64.22 -41.61 96.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.774 0.321 . . . . 0.0 110.655 -179.859 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.715 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -61.83 -47.91 82.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.491 179.455 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.565 HD11 ' HE3' ' A' ' 69' ' ' MET . 31.0 mt -60.19 -48.08 89.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.624 179.715 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -64.05 -39.78 94.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.752 179.767 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -65.12 -44.34 89.03 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.536 179.678 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.728 HD21 ' HB2' ' A' ' 51' ' ' ALA . 0.3 OUTLIER -54.21 -57.6 10.54 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.504 -0.317 . . . . 0.0 110.373 179.397 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.946 HD11 HG13 ' A' ' 19' ' ' VAL . 61.6 mt -56.63 -30.88 33.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 N-CA-C 110.162 -0.311 . . . . 0.0 110.162 179.218 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -58.66 -36.55 74.32 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.513 0.673 . . . . 0.0 109.571 178.403 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.539 ' HB2' ' HB1' ' A' ' 62' ' ' ALA . 0.0 OUTLIER -75.6 -28.04 58.75 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.8 -1.091 . . . . 0.0 110.024 179.258 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.639 ' O ' HD12 ' A' ' 84' ' ' LEU . 77.7 mt -62.79 -49.6 74.34 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 177.438 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.642 ' OE2' HD23 ' A' ' 26' ' ' LEU . 3.4 tt0 -62.68 -46.13 89.6 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 114.293 -1.321 . . . . 0.0 110.744 177.87 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.74 -37.53 86.93 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.939 -179.433 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 44.3 mt-30 -75.71 -37.7 59.2 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.884 0.373 . . . . 0.0 110.803 179.88 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.653 ' HA ' HD12 ' A' ' 87' ' ' LEU . 2.2 mt -64.24 -25.37 68.03 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.695 179.668 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -64.15 -28.0 69.46 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.538 179.661 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 16.2 mmtt -72.66 -22.37 60.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.102 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.653 HD12 ' HA ' ' A' ' 84' ' ' LEU . 9.9 mt -68.75 -53.89 19.21 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.873 0.368 . . . . 0.0 110.568 179.827 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 61.5 mt-30 -77.16 -8.84 58.21 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.094 179.581 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 7.2 m-70 58.57 177.71 0.07 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.033 179.91 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 2.0 mmmp? -169.6 -43.77 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.811 179.828 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -115.3 -32.12 1.88 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.518 179.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -121.13 136.56 54.95 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.804 0.335 . . . . 0.0 110.863 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -171.1 152.74 3.53 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.165 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.09 140.55 18.76 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.869 -179.952 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.58 143.97 25.99 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.868 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -93.36 -177.66 4.5 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.106 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -155.14 155.06 33.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.123 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -151.6 -68.17 0.17 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.917 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 19.8 m 63.2 124.01 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.97 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.639 HG22 ' O ' ' A' ' 100' ' ' VAL . 14.7 p -130.53 16.42 2.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.401 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 1.2 mmpt? 60.04 111.47 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.809 0.337 . . . . 0.0 110.959 179.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -157.52 106.84 2.14 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.905 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -138.61 -51.41 0.57 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.167 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 11.5 p30 -60.14 173.46 0.64 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.928 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.417 ' O ' HG12 ' A' ' 106' ' ' VAL . 17.2 m-85 -159.63 -177.96 6.75 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.854 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.574 HG22 ' O ' ' A' ' 106' ' ' VAL . 13.6 p 43.52 45.61 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.18 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.62 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 58.2 mt-10 -58.02 -29.3 65.22 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.089 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -60.46 168.66 2.02 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.922 179.932 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 11.2 p -150.92 136.99 12.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.067 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 7.7 tm-20 60.66 109.79 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.888 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -132.3 168.22 18.48 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.828 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.178 -0.915 . . . . 0.0 110.953 -179.989 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 85.9 m . . . . . 0 N--CA 1.486 1.365 0 CA-C-O 120.856 0.36 . . . . 0.0 111.216 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . 0.493 ' CE ' ' HB2' ' A' ' 20' ' ' ALA . 3.2 mpp? -113.01 156.46 23.03 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.916 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.406 ' HB3' ' CD2' ' A' ' 37' ' ' HIS . 2.8 m120 -122.91 114.27 20.22 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.26 -179.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 36.4 mt -123.55 123.86 68.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.68 179.617 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -134.99 157.5 46.78 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.998 0.428 . . . . 0.0 111.366 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 22.4 p -164.69 139.59 5.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.436 -179.761 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -102.03 25.31 8.9 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.188 -179.736 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 2.5 tp60 -140.89 15.53 2.3 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.164 179.648 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER 173.72 -177.33 0.08 Allowed 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.984 0.421 . . . . 0.0 110.74 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -110.69 172.51 6.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.651 179.838 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.8 mm -91.01 113.22 26.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 121.009 0.433 . . . . 0.0 111.173 -179.579 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 12.5 p -98.83 157.39 34.24 Favored Pre-proline 0 C--N 1.327 -0.405 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.959 179.809 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.429 ' HA ' ' HG2' ' A' ' 16' ' ' ARG . 23.9 Cg_exo -62.55 -13.51 33.9 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.579 2.186 . . . . 0.0 111.984 179.204 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -86.1 -41.01 15.11 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.058 0.456 . . . . 0.0 110.428 179.397 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.702 ' O ' HG23 ' A' ' 19' ' ' VAL . 24.5 mt -72.7 -29.29 29.72 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.29 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.813 179.265 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.429 ' HG2' ' HA ' ' A' ' 13' ' ' PRO . 2.2 ptm180 -74.99 -43.4 54.15 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.868 -0.605 . . . . 0.0 109.544 178.935 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -67.39 -37.94 83.91 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.696 178.922 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.463 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 82.1 t60 -60.63 -53.65 54.86 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 178.55 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.798 ' O ' ' HG3' ' A' ' 22' ' ' ARG . 23.9 t -62.55 -49.28 84.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.209 178.312 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.551 ' HA ' ' CG ' ' A' ' 23' ' ' LEU . . . -55.65 -37.91 68.85 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.759 -0.376 . . . . 0.0 111.875 179.762 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.463 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 0.9 OUTLIER -64.37 -32.53 74.18 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.37 -0.532 . . . . 0.0 110.477 179.335 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.798 ' HG3' ' O ' ' A' ' 19' ' ' VAL . 0.0 OUTLIER -77.9 -39.72 42.14 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.914 -0.585 . . . . 0.0 112.486 -179.283 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.65 ' CD2' HG12 ' A' ' 19' ' ' VAL . 0.0 OUTLIER -65.24 -48.51 73.04 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 120.034 -0.666 . . . . 0.0 110.843 -179.463 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.31 -24.79 66.68 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.15 179.556 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 2.9 tppp? -79.14 -34.29 43.39 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.854 179.888 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.663 HD23 ' HE1' ' A' ' 29' ' ' TRP . 0.8 OUTLIER -81.22 56.97 3.02 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.908 -179.991 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -109.86 -12.28 14.6 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.513 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.437 ' HE3' ' CD2' ' A' ' 29' ' ' TRP . 0.2 OUTLIER -66.08 -14.11 61.18 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.735 0.302 . . . . 0.0 111.483 -179.922 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.663 ' HE1' HD23 ' A' ' 26' ' ' LEU . 66.1 m95 -84.92 165.02 17.99 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.095 -179.827 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.478 ' O ' HG22 ' A' ' 31' ' ' THR . 6.9 mp0 -84.2 -130.59 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.216 179.637 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.478 HG22 ' O ' ' A' ' 30' ' ' GLN . 15.3 t 45.0 -166.97 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.146 0 CA-C-O 120.836 0.35 . . . . 0.0 111.21 179.832 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . 0.608 ' C ' HD12 ' A' ' 33' ' ' LEU . 97.4 m-70 -144.38 -41.04 0.26 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.224 -179.73 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.608 HD12 ' C ' ' A' ' 32' ' ' HIS . 1.0 OUTLIER 66.15 147.63 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.203 -179.531 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.593 HG22 ' OD1' ' A' ' 35' ' ' ASN . 25.0 mt -138.47 111.07 6.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 121.335 0.588 . . . . 0.0 112.193 -179.604 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.593 ' OD1' HG22 ' A' ' 34' ' ' ILE . 25.1 m120 62.88 81.19 0.23 Allowed Pre-proline 0 C--N 1.327 -0.384 0 CA-C-N 115.091 -0.958 . . . . 0.0 112.312 178.96 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.403 ' HB3' HG23 ' A' ' 53' ' ' ILE . 69.4 Cg_endo -81.89 145.08 14.0 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.988 2.459 . . . . 0.0 111.433 178.71 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . 0.406 ' CD2' ' HB3' ' A' ' 3' ' ' ASN . 2.2 t-160 -134.4 130.97 37.65 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.125 0.488 . . . . 0.0 111.635 -179.455 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 9.1 mm -120.13 133.76 65.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.388 179.495 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 2.1 mp -119.11 146.26 24.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.002 -179.815 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 45.8 mt -124.13 126.85 46.88 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.888 179.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -123.65 -173.93 2.86 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.398 179.696 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.409 ' HG3' ' CD2' ' A' ' 47' ' ' PHE . 15.1 tttt -159.7 140.66 12.45 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.425 0.631 . . . . 0.0 111.489 -179.667 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -131.58 156.82 79.62 Favored Pre-proline 0 C--N 1.323 -0.566 0 CA-C-N 114.934 -1.03 . . . . 0.0 109.195 179.15 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_exo -52.12 -24.47 20.15 Favored 'Trans proline' 0 N--CA 1.465 -0.183 0 C-N-CA 121.854 1.703 . . . . 0.0 112.418 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -89.64 -6.71 55.93 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.499 -0.773 . . . . 0.0 112.833 -179.178 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 149.94 -164.35 29.57 Favored Glycine 0 C--O 1.224 -0.503 0 C-N-CA 120.214 -0.993 . . . . 0.0 112.154 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.41 ' CD1' ' N ' ' A' ' 47' ' ' PHE . 18.3 m-85 -108.35 153.63 22.99 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.57 0.7 . . . . 0.0 111.854 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.623 HG22 ' CG ' ' A' ' 65' ' ' LYS . 54.1 t -127.36 140.7 48.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 114.82 -1.082 . . . . 0.0 111.023 -179.281 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -131.84 124.11 28.92 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.677 179.682 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 67.8 m-20 -118.89 147.33 44.11 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.685 0.278 . . . . 0.0 110.743 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.6 ' CB ' HD11 ' A' ' 76' ' ' LEU . . . -144.97 141.19 28.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.875 0.369 . . . . 0.0 111.547 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.629 ' O ' HD13 ' A' ' 53' ' ' ILE . 6.4 m -135.29 133.49 38.94 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.361 179.576 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.648 ' O ' HG13 ' A' ' 59' ' ' VAL . 1.1 mm -132.31 134.38 59.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.843 0.354 . . . . 0.0 111.13 -179.825 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 23.7 m120 -103.24 118.29 36.45 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.438 179.026 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.444 HG22 ' HG ' ' A' ' 33' ' ' LEU . 30.3 p -113.61 153.98 45.73 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.877 179.93 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_exo -61.87 -15.46 43.02 Favored 'Trans proline' 0 C--N 1.343 0.263 0 C-N-CA 122.564 2.176 . . . . 0.0 112.655 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 -118.89 21.98 12.17 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.616 -0.265 . . . . 0.0 111.691 -179.546 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 141.84 -165.46 26.52 Favored Glycine 0 C--N 1.33 0.243 0 C-N-CA 120.376 -0.916 . . . . 0.0 113.053 179.756 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.648 HG13 ' O ' ' A' ' 53' ' ' ILE . 12.5 t -142.24 142.29 27.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.822 0.344 . . . . 0.0 111.02 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -117.64 148.99 41.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.192 -179.792 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 12.4 t -138.87 145.6 27.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.874 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.479 ' O ' HD12 ' A' ' 76' ' ' LEU . . . -153.43 150.97 29.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.168 0.509 . . . . 0.0 111.604 -179.723 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 11.5 p -143.04 158.7 43.36 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.643 -179.41 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.56 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -153.46 109.77 0.42 Allowed Glycine 0 C--N 1.33 0.232 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.61 179.639 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.623 ' CG ' HG22 ' A' ' 48' ' ' VAL . 60.7 mttt -110.68 45.14 1.17 Allowed 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -178.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 12.3 t-80 -75.79 156.36 34.61 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 110.207 -0.294 . . . . 0.0 110.207 178.543 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -61.1 -26.7 67.84 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.72 0.295 . . . . 0.0 111.295 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -98.53 120.8 39.57 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.023 0.439 . . . . 0.0 111.371 -179.378 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 13.2 ttt -48.04 -50.72 26.94 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.953 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -65.56 -40.23 92.6 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.268 -179.296 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 37.9 m -64.74 -40.44 95.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.801 0.334 . . . . 0.0 110.679 179.891 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.56 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -62.17 -49.36 76.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.648 179.506 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 12.9 mt -60.4 -45.1 97.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.878 0.37 . . . . 0.0 110.266 179.512 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -64.45 -37.82 88.85 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.261 179.264 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -65.85 -42.23 90.71 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.183 179.233 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.6 HD11 ' CB ' ' A' ' 51' ' ' ALA . 0.3 OUTLIER -53.57 -56.24 18.78 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 178.4 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.54 HD13 ' CG ' ' A' ' 22' ' ' ARG . 37.4 mt -56.79 -30.63 33.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.17 178.493 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -57.93 -35.77 71.55 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.548 0.69 . . . . 0.0 109.305 178.241 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.3 mptp? -78.92 -31.27 45.16 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 114.7 -1.136 . . . . 0.0 110.208 179.065 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.501 HD12 ' HA ' ' A' ' 77' ' ' ILE . 76.4 mt -63.07 -50.39 70.76 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 177.775 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -60.46 -47.6 85.42 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 114.942 -1.027 . . . . 0.0 110.22 177.522 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 59.7 mtt180 -62.96 -24.57 67.95 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.819 179.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 7.2 mt-30 -75.44 -44.24 45.4 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.615 179.757 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.633 HD13 ' CG ' ' A' ' 29' ' ' TRP . 28.3 mt -64.79 -27.4 68.86 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.835 179.866 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -63.55 -33.06 74.76 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.018 0.437 . . . . 0.0 110.549 179.75 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 18.6 mmtt -73.31 -25.95 60.86 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.966 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.505 ' O ' HD23 ' A' ' 87' ' ' LEU . 3.3 tt -69.45 -16.62 63.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.196 179.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 34.8 mt-30 -76.52 -5.72 48.77 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.477 -179.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.433 ' O ' ' CB ' ' A' ' 90' ' ' LYS . 5.9 p80 -154.8 -177.04 6.23 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.729 0.299 . . . . 0.0 110.903 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.433 ' CB ' ' O ' ' A' ' 89' ' ' HIS . 1.2 ttpm? 83.41 89.46 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.829 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -75.87 -29.24 59.44 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.493 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 60.93 -177.89 0.11 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.826 0.346 . . . . 0.0 110.932 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -134.83 167.16 21.38 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.124 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -92.39 155.23 18.03 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.919 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 10.8 mtt-85 -135.62 -56.58 0.79 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.925 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -146.53 134.25 21.12 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.138 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -65.37 -56.07 14.61 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.099 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.8 133.36 35.26 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.882 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -177.56 -41.59 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.872 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 28.4 t -63.23 -67.16 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.12 -179.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 16.7 mttm -105.8 115.52 30.39 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.947 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -85.79 -172.74 4.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.859 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -134.55 -46.16 0.75 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.131 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -90.62 158.31 17.01 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.989 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.497 ' O ' HG22 ' A' ' 106' ' ' VAL . 0.1 OUTLIER 66.89 -73.21 0.08 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.952 -179.999 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.497 HG22 ' O ' ' A' ' 105' ' ' PHE . 21.5 m 45.13 -171.26 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.665 179.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -90.76 87.75 6.8 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.836 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -75.87 156.33 34.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.993 -179.882 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.484 HG12 ' HG3' ' A' ' 110' ' ' GLU . 26.0 t 67.68 -70.88 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.134 179.914 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . 0.484 ' HG3' HG12 ' A' ' 109' ' ' VAL . 0.0 OUTLIER 177.22 -44.36 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.803 179.986 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -175.78 175.39 2.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.852 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.167 -0.92 . . . . 0.0 110.893 -179.968 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 2.6 m . . . . . 0 N--CA 1.486 1.328 0 CA-C-O 120.773 0.321 . . . . 0.0 111.259 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . 0.722 ' CE ' HD11 ' A' ' 4' ' ' ILE . 0.0 OUTLIER -58.05 170.93 0.59 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.054 -179.905 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -116.7 136.43 52.97 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.483 -179.497 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.722 HD11 ' CE ' ' A' ' 2' ' ' MET . 34.7 mt -126.27 125.39 67.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.408 179.386 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.455 ' OG1' HD13 ' A' ' 39' ' ' ILE . 2.9 p -134.35 161.2 35.65 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.869 0.366 . . . . 0.0 111.18 179.949 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 29.1 p -163.38 138.3 6.33 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.551 -179.45 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 20.3 mttt -101.74 31.48 3.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.931 -179.769 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -141.19 -47.48 0.39 Allowed 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.805 179.743 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 1.5 mpp? -120.37 -170.36 1.97 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.748 179.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -118.41 164.96 14.47 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.572 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.467 ' CD1' HG22 ' A' ' 4' ' ' ILE . 4.1 mm -89.95 115.1 28.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 121.073 0.463 . . . . 0.0 110.945 -179.576 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.546 ' H ' HD12 ' A' ' 15' ' ' ILE . 20.1 p -100.35 155.81 35.97 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.924 179.79 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_exo -59.56 -17.51 42.03 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.39 2.06 . . . . 0.0 111.822 179.147 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.01 -40.47 22.06 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-O 121.108 0.48 . . . . 0.0 110.226 179.21 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.546 HD12 ' H ' ' A' ' 12' ' ' THR . 19.1 mt -73.42 -28.72 25.88 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.594 179.019 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.57 -45.01 48.12 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.169 178.819 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 42.9 tt0 -67.74 -37.32 82.01 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.371 178.809 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.427 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 57.6 t60 -59.29 -60.02 4.53 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 178.648 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.544 HG23 ' O ' ' A' ' 15' ' ' ILE . 21.3 t -60.77 -45.36 97.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 110.142 -0.318 . . . . 0.0 110.142 178.396 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.681 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -57.65 -42.07 82.72 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.538 179.394 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.427 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 0.9 OUTLIER -59.67 -33.23 71.29 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 121.075 0.464 . . . . 0.0 110.043 179.607 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 19.8 mmm180 -74.15 -26.07 60.1 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.516 179.316 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.681 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 14.7 mt -66.44 -53.12 39.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.016 0.436 . . . . 0.0 109.942 178.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.77 -22.25 63.89 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.757 179.057 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 6.5 tptp -78.8 -28.08 44.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.15 179.191 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.592 HD22 ' CB ' ' A' ' 29' ' ' TRP . 33.5 mt -76.84 60.22 1.72 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.824 -179.844 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.16 -61.01 2.66 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.214 -179.785 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.445 ' HG2' ' NE1' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -90.03 39.72 0.97 Allowed 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.112 0.482 . . . . 0.0 110.672 179.675 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.653 ' HB3' HD13 ' A' ' 84' ' ' LEU . 23.4 m95 -147.87 -36.2 0.21 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.426 -178.776 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 14.3 tt0 -70.47 65.38 0.29 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.945 0.402 . . . . 0.0 110.278 179.478 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -78.26 -164.47 0.55 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.026 -179.471 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 94.7 m-70 -60.05 83.25 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.46 -179.599 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.738 HD22 HG21 ' A' ' 53' ' ' ILE . 37.3 mt -92.14 143.77 26.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.115 -0.493 . . . . 0.0 109.976 179.202 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.741 HG22 ' ND2' ' A' ' 35' ' ' ASN . 3.5 mp -138.51 114.95 10.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.858 0.837 . . . . 0.0 112.164 -179.931 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.741 ' ND2' HG22 ' A' ' 34' ' ' ILE . 22.2 m-80 72.02 49.0 0.26 Allowed Pre-proline 0 C--N 1.327 -0.393 0 CA-C-N 114.144 -1.389 . . . . 0.0 111.726 179.183 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.457 ' HG2' ' HA ' ' A' ' 2' ' ' MET . 19.4 Cg_endo -62.29 125.64 16.77 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.08 1.854 . . . . 0.0 112.052 -179.36 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -140.11 126.95 20.63 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.549 -0.46 . . . . 0.0 111.865 -179.814 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.638 ' N ' HD12 ' A' ' 38' ' ' ILE . 3.4 mp -119.34 138.35 50.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.418 179.323 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.455 HD13 ' OG1' ' A' ' 5' ' ' THR . 22.1 mm -116.05 148.38 18.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.46 -179.485 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 11.0 mt -122.88 127.19 48.65 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.518 179.615 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 11.7 m -125.33 -171.16 2.31 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.789 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.46 ' HA ' ' HA ' ' A' ' 47' ' ' PHE . 5.2 ttpt -173.58 146.63 1.34 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.128 0.49 . . . . 0.0 110.765 -179.791 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.443 ' HB3' ' HD2' ' A' ' 44' ' ' PRO . 2.1 mt-10 -132.04 170.5 11.15 Favored Pre-proline 0 C--N 1.324 -0.506 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.299 179.228 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . 0.443 ' HD2' ' HB3' ' A' ' 43' ' ' GLU . 69.0 Cg_exo -51.45 -19.7 7.43 Favored 'Trans proline' 0 N--CA 1.464 -0.241 0 C-N-CA 121.727 1.618 . . . . 0.0 112.302 -179.502 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -86.12 -77.95 0.29 Allowed 'General case' 0 N--CA 1.445 -0.724 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.104 179.344 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . 0.452 ' HA3' ' HA ' ' A' ' 67' ' ' GLU . . . -141.77 -155.68 6.55 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.859 -179.309 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.46 ' HA ' ' HA ' ' A' ' 42' ' ' LYS . 21.9 m-85 -108.94 151.13 26.72 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-O 121.639 0.733 . . . . 0.0 112.699 -179.232 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.519 HG22 ' CB ' ' A' ' 65' ' ' LYS . 75.7 t -124.98 141.45 45.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 114.482 -1.236 . . . . 0.0 110.517 -179.659 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.402 ' O ' ' HA ' ' A' ' 63' ' ' SER . . . -132.44 124.09 27.94 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.654 -0.248 . . . . 0.0 110.797 179.787 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 21.2 m-20 -119.04 149.19 42.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.602 -0.272 . . . . 0.0 110.547 179.858 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.467 ' N ' HD11 ' A' ' 76' ' ' LEU . . . -146.69 140.42 25.92 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.829 0.347 . . . . 0.0 111.317 179.849 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.6 m -135.12 131.56 37.02 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.033 179.402 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.738 HG21 HD22 ' A' ' 33' ' ' LEU . 17.4 mt -133.33 136.4 54.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 121.013 0.435 . . . . 0.0 111.456 -179.547 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -103.6 131.28 50.88 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.148 178.963 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.573 ' HB ' ' HD2' ' A' ' 56' ' ' PRO . 5.8 p -127.83 163.33 43.98 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.444 -179.904 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.573 ' HD2' ' HB ' ' A' ' 55' ' ' THR . 53.6 Cg_endo -70.83 -5.67 17.41 Favored 'Trans proline' 0 C--N 1.343 0.25 0 C-N-CA 122.321 2.014 . . . . 0.0 112.687 179.921 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 67.7 m-80 -124.82 22.12 8.19 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.685 -0.234 . . . . 0.0 111.379 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 133.68 -167.76 23.46 Favored Glycine 0 C--N 1.33 0.212 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.784 179.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.675 HG13 ' O ' ' A' ' 53' ' ' ILE . 14.1 t -137.24 144.7 31.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 120.665 0.269 . . . . 0.0 111.008 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.567 HD22 ' HG ' ' A' ' 84' ' ' LEU . 3.7 mp -119.34 152.4 36.82 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.108 -179.97 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.435 ' O ' ' NE2' ' A' ' 83' ' ' GLN . 9.3 p -143.0 145.36 22.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.866 179.7 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -152.01 156.82 40.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.054 0.454 . . . . 0.0 111.814 -179.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.438 ' HA ' HD12 ' A' ' 76' ' ' LEU . 4.0 m -145.04 156.05 43.71 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.858 -179.155 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.606 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -150.15 105.38 0.29 Allowed Glycine 0 CA--C 1.519 0.324 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.445 179.355 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.519 ' CB ' HG22 ' A' ' 48' ' ' VAL . 2.1 mtpp -108.68 45.9 1.0 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.57 0.581 . . . . 0.0 112.57 -178.618 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.605 ' ND1' HG21 ' A' ' 71' ' ' THR . 12.8 t-80 -76.73 156.52 32.4 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.795 0.331 . . . . 0.0 110.28 178.547 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.452 ' HA ' ' HA3' ' A' ' 46' ' ' GLY . 2.0 pt-20 -61.89 -26.98 68.48 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.798 0.333 . . . . 0.0 111.3 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -97.68 123.12 41.47 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.106 0.479 . . . . 0.0 111.564 -179.313 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 26.0 ttt -48.35 -49.14 35.51 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.693 179.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 -66.32 -38.78 88.47 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.466 -179.211 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.605 HG21 ' ND1' ' A' ' 66' ' ' HIS . 84.7 m -64.53 -41.51 96.33 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.719 -179.889 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.606 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -61.78 -48.7 79.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.646 179.599 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 25.4 mt -60.34 -46.85 94.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 120.891 0.377 . . . . 0.0 110.564 179.647 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -64.16 -39.2 93.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.615 179.558 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -65.46 -47.4 76.27 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.363 179.533 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.467 HD11 ' N ' ' A' ' 51' ' ' ALA . 0.5 OUTLIER -50.75 -57.82 7.42 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 179.204 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.54 HD13 HD12 ' A' ' 80' ' ' LEU . 22.9 mm -56.04 -32.16 32.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 178.482 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -59.94 -27.83 67.12 Favored 'General case' 0 N--CA 1.442 -0.839 0 CA-C-O 121.099 0.476 . . . . 0.0 110.596 178.487 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.99 -26.87 23.57 Favored 'General case' 0 CA--C 1.521 -0.135 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.219 179.27 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.729 ' O ' HD12 ' A' ' 84' ' ' LEU . 57.0 mt -62.87 -51.03 68.57 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 108.004 -1.109 . . . . 0.0 108.004 177.6 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -61.2 -44.83 96.65 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 114.567 -1.197 . . . . 0.0 110.778 177.841 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.51 -38.78 91.26 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.005 -179.356 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.435 ' NE2' ' O ' ' A' ' 61' ' ' VAL . 42.5 mt-30 -74.23 -39.15 63.27 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.874 0.369 . . . . 0.0 110.738 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.729 HD12 ' O ' ' A' ' 80' ' ' LEU . 2.9 mt -64.96 -26.88 68.49 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.814 179.599 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 39.6 t30 -62.3 -38.15 88.28 Favored 'General case' 0 CA--C 1.523 -0.09 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.315 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 19.7 mttt -73.56 -25.33 60.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.975 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 27.5 mt -69.59 -15.58 63.24 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.271 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -76.38 -74.2 0.24 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.225 0.536 . . . . 0.0 110.927 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -83.75 161.22 21.07 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.982 179.974 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -169.76 165.21 9.95 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.93 179.864 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -128.32 -102.98 1.13 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.519 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 71.0 mt-10 -136.07 133.54 37.46 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.766 0.317 . . . . 0.0 110.939 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -113.92 109.9 19.24 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.081 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -108.39 128.52 54.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.935 179.968 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.48 89.72 3.16 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.938 179.938 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -124.28 71.8 1.15 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.116 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -106.73 120.55 42.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.167 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 82.6 p -71.47 -177.98 2.0 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.884 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 15.9 m -94.21 176.84 6.17 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.907 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 6.3 m -120.06 134.42 63.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.08 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 17.2 mtmt -80.46 107.76 13.53 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.044 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -155.3 174.01 15.82 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.836 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -151.18 106.3 3.32 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.132 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -149.21 33.57 0.73 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.786 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -128.89 137.79 51.64 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.887 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.453 ' O ' HG23 ' A' ' 106' ' ' VAL . 15.3 m -148.7 73.31 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.068 179.886 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 67.96 -69.25 0.15 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.061 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 61.09 90.79 0.06 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.844 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.404 HG23 ' N ' ' A' ' 110' ' ' GLU . 6.3 m -134.42 -45.89 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.212 -179.939 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . 0.404 ' N ' HG23 ' A' ' 109' ' ' VAL . 2.3 mt-10 62.71 31.43 16.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.939 179.985 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.01 143.38 47.57 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.837 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 18.5 pt-20 . . . . . 0 C--O 1.25 1.108 0 CA-C-O 118.248 -0.882 . . . . 0.0 111.401 -179.999 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . 0.513 ' O ' HG23 ' A' ' 1' ' ' THR . 9.4 t . . . . . 0 N--CA 1.487 1.4 0 CA-C-O 120.762 0.315 . . . . 0.0 111.254 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . 0.471 ' SD ' HD12 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -76.12 135.98 39.83 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.921 179.96 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 31.5 t-20 -121.89 119.06 30.49 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.42 -179.52 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 36.4 mt -118.27 123.73 72.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.476 179.363 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -134.67 160.44 38.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.97 0.414 . . . . 0.0 111.281 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 21.6 p -163.92 142.42 7.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.584 -179.67 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 10.6 mttt -100.9 28.49 5.2 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.892 -179.809 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 3.5 tp-100 -141.25 -46.08 0.38 Allowed 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.622 179.692 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 5.4 mpp? -114.0 -176.81 2.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.683 179.764 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -120.52 169.74 10.05 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.518 179.819 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.714 ' CD1' ' N ' ' A' ' 11' ' ' ILE . 0.3 OUTLIER -88.44 101.69 12.01 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.012 0 CA-C-O 121.547 0.689 . . . . 0.0 110.623 -178.474 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 17.6 p -95.55 151.1 38.32 Favored Pre-proline 0 C--N 1.322 -0.606 0 CA-C-N 114.695 -1.139 . . . . 0.0 110.877 179.735 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -54.78 -26.64 48.52 Favored 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 122.438 2.092 . . . . 0.0 111.803 179.182 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -74.48 -44.48 51.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.578 179.406 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.651 ' O ' HG23 ' A' ' 19' ' ' VAL . 21.3 mt -72.18 -27.78 27.66 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.326 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 178.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.5 -44.94 33.13 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.549 -0.751 . . . . 0.0 109.728 178.772 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 43.9 tt0 -67.67 -40.46 84.44 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.762 179.114 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.527 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 77.8 t60 -60.62 -58.02 10.23 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 179.167 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.651 HG23 ' O ' ' A' ' 15' ' ' ILE . 25.2 t -60.7 -47.87 91.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.693 0.282 . . . . 0.0 110.32 178.704 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.717 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -59.04 -40.6 85.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.226 -0.443 . . . . 0.0 112.039 179.662 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.527 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 0.9 OUTLIER -59.7 -35.1 73.82 Favored 'General case' 0 C--N 1.332 -0.166 0 C-N-CA 120.512 -0.475 . . . . 0.0 109.887 179.737 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.615 ' O ' HD12 ' A' ' 26' ' ' LEU . 5.6 mmm180 -76.53 -27.36 55.94 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.658 179.567 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.717 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 3.5 mt -68.54 -58.21 4.63 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.083 0.468 . . . . 0.0 110.529 179.687 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.65 -23.73 65.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.314 179.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 6.8 tmtt? -79.42 -29.79 42.05 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.132 0.491 . . . . 0.0 110.462 179.541 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.854 HD23 ' CD1' ' A' ' 29' ' ' TRP . 6.9 mt -79.34 58.29 2.55 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.077 -179.802 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.56 -73.49 0.08 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.216 -179.824 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.45 ' HD2' ' CE3' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -49.94 -27.78 5.8 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.216 0.531 . . . . 0.0 111.061 -179.791 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.854 ' CD1' HD23 ' A' ' 26' ' ' LEU . 34.1 m95 -87.83 45.12 1.24 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.357 179.828 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.599 ' HA ' HD11 ' A' ' 33' ' ' LEU . 27.7 mt-30 -157.43 70.51 0.6 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.112 179.749 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -77.59 -78.56 0.13 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.359 -179.086 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . 0.455 ' HB3' ' HD2' ' A' ' 56' ' ' PRO . 0.8 OUTLIER -133.24 65.11 1.6 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.565 -179.278 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.951 HD22 HG21 ' A' ' 53' ' ' ILE . 1.8 mt -89.99 146.05 24.65 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.066 179.237 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 29.3 mt -135.12 107.42 8.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 121.087 0.47 . . . . 0.0 112.036 -179.524 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 1.9 m120 51.67 74.36 0.81 Allowed Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 115.583 -0.735 . . . . 0.0 112.165 179.077 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.513 ' HB3' HG23 ' A' ' 53' ' ' ILE . 95.3 Cg_endo -78.55 131.09 10.22 Favored 'Trans proline' 0 N--CA 1.463 -0.319 0 C-N-CA 122.557 2.172 . . . . 0.0 111.524 179.162 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . 0.504 ' C ' HD12 ' A' ' 38' ' ' ILE . 1.7 t-160 -107.43 129.79 54.89 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.07 0.462 . . . . 0.0 111.778 -179.261 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.642 ' N ' HD12 ' A' ' 38' ' ' ILE . 3.4 mp -121.09 133.17 68.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.526 179.45 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 5.2 mt -118.89 149.2 21.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.228 -179.78 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 8.9 mt -124.93 126.86 46.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.89 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 34.6 m -123.49 -173.83 2.82 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.507 179.739 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.432 ' HG3' ' CD2' ' A' ' 47' ' ' PHE . 3.4 ttpt -160.48 139.05 10.22 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.306 0.574 . . . . 0.0 111.333 -179.644 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -130.76 156.56 79.71 Favored Pre-proline 0 C--N 1.323 -0.583 0 CA-C-N 115.129 -0.941 . . . . 0.0 109.281 179.146 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_exo -51.34 -24.55 16.11 Favored 'Trans proline' 0 C--O 1.232 0.187 0 C-N-CA 121.974 1.783 . . . . 0.0 112.481 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -89.07 -6.2 57.29 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.456 -0.793 . . . . 0.0 112.662 -179.242 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 149.16 -161.55 28.76 Favored Glycine 0 C--O 1.224 -0.48 0 C-N-CA 120.245 -0.979 . . . . 0.0 112.129 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.432 ' CD2' ' HG3' ' A' ' 42' ' ' LYS . 16.9 m-85 -110.36 154.59 23.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.523 0.678 . . . . 0.0 111.98 179.923 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.528 HG22 ' HG2' ' A' ' 65' ' ' LYS . 68.8 t -128.08 139.34 52.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 114.867 -1.06 . . . . 0.0 110.94 -179.266 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.437 ' O ' ' HA ' ' A' ' 63' ' ' SER . . . -131.27 124.51 30.65 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.761 179.715 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -118.96 147.98 43.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.743 0.306 . . . . 0.0 110.999 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.499 ' N ' HD11 ' A' ' 76' ' ' LEU . . . -144.29 141.42 29.79 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.558 179.886 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.1 m -135.79 130.3 33.83 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.014 179.4 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.951 HG21 HD22 ' A' ' 33' ' ' LEU . 11.7 mt -130.54 134.19 62.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 120.825 0.345 . . . . 0.0 110.904 -179.54 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -104.24 133.49 49.07 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.68 179.623 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.42 HG22 ' HA ' ' A' ' 33' ' ' LEU . 6.3 p -134.29 135.25 23.7 Favored Pre-proline 0 C--N 1.326 -0.421 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.347 179.476 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.455 ' HD2' ' HB3' ' A' ' 32' ' ' HIS . 80.8 Cg_exo -45.87 -20.81 0.81 Allowed 'Trans proline' 0 CA--C 1.53 0.29 0 C-N-CA 122.381 2.054 . . . . 0.0 112.921 179.853 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -111.48 20.69 16.97 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 112.095 0.406 . . . . 0.0 112.095 -179.571 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 142.44 -174.71 23.25 Favored Glycine 0 C--N 1.332 0.342 0 C-N-CA 120.286 -0.959 . . . . 0.0 113.319 179.52 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.638 HG13 ' O ' ' A' ' 53' ' ' ILE . 21.2 t -143.85 139.62 25.35 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-O 120.789 0.328 . . . . 0.0 111.005 -179.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.5 mp -117.85 153.76 32.97 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.009 0.433 . . . . 0.0 111.612 -179.418 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 16.7 t -140.49 145.64 25.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.714 179.742 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -153.15 152.57 31.42 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.189 0.519 . . . . 0.0 111.841 -179.579 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.483 ' HA ' HD12 ' A' ' 76' ' ' LEU . 0.1 OUTLIER -144.89 158.08 43.93 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.666 -179.437 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.615 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -151.55 105.28 0.28 Allowed Glycine 0 C--N 1.331 0.298 0 N-CA-C 111.497 -0.641 . . . . 0.0 111.497 179.341 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.528 ' HG2' HG22 ' A' ' 48' ' ' VAL . 0.3 OUTLIER -106.71 44.83 1.02 Allowed 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.281 0.474 . . . . 0.0 112.281 -178.834 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 16.5 t-80 -75.4 156.36 35.45 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.635 -0.257 . . . . 0.0 110.317 178.601 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -59.61 -28.62 67.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.489 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 9.0 t0 -97.98 119.6 36.9 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.972 0.415 . . . . 0.0 111.566 -179.292 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.422 ' O ' HD12 ' A' ' 73' ' ' ILE . 3.7 ttt -47.86 -47.01 31.84 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.516 179.846 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 35.5 m-85 -66.45 -42.28 87.82 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.151 -179.521 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 56.7 m -65.33 -37.4 86.98 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.669 179.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.615 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -62.4 -50.6 70.88 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.747 179.588 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.483 HG21 HG22 ' A' ' 19' ' ' VAL . 6.7 mt -61.97 -41.3 90.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 179.412 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -64.44 -41.45 96.56 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.062 179.091 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -66.31 -39.43 89.31 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.496 179.367 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.733 HD23 HG13 ' A' ' 77' ' ' ILE . 0.4 OUTLIER -54.97 -63.73 1.06 Allowed 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 179.079 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.733 HG13 HD23 ' A' ' 76' ' ' LEU . 4.8 mt -54.64 -26.89 17.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 110.274 -0.269 . . . . 0.0 110.274 178.871 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -59.23 -40.22 85.21 Favored 'General case' 0 N--CA 1.455 -0.208 0 CA-C-O 121.48 0.657 . . . . 0.0 109.282 178.087 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 7.3 mmtm -73.94 -31.38 63.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 114.916 -1.038 . . . . 0.0 110.205 178.817 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.79 ' O ' HD12 ' A' ' 84' ' ' LEU . 84.7 mt -62.88 -47.38 83.57 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 107.817 -1.179 . . . . 0.0 107.817 177.593 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.443 ' HG2' ' CE2' ' A' ' 29' ' ' TRP . 6.3 tt0 -60.73 -46.25 91.14 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 114.821 -1.082 . . . . 0.0 110.32 177.65 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.42 -31.24 72.34 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.741 -179.858 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 -74.81 -45.32 44.29 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.942 0.401 . . . . 0.0 110.436 179.684 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.79 HD12 ' O ' ' A' ' 80' ' ' LEU . 1.4 mt -65.28 -26.17 67.96 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.865 179.681 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -62.71 -31.94 72.95 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.055 0.455 . . . . 0.0 110.357 179.647 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.32 -19.97 60.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.246 179.888 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 90.2 mt -69.26 -17.18 63.73 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.359 -179.808 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -76.27 -5.45 47.04 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.426 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.48 ' N ' ' CD2' ' A' ' 89' ' ' HIS . 1.3 p80 -154.84 137.8 15.47 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.926 0.393 . . . . 0.0 110.961 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 23.8 tptt -170.37 -68.49 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.966 179.605 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 107.35 28.01 5.06 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.484 -179.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -84.5 -177.81 6.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.807 0.337 . . . . 0.0 110.93 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -143.94 129.04 18.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.043 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 6.2 ttp180 -93.38 -33.85 13.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.911 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.25 115.38 18.24 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.929 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . 61.95 90.63 0.07 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.12 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -72.86 -24.13 60.83 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.202 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 2.6 m 70.66 -64.35 0.38 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.945 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -54.88 160.13 2.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.949 -179.972 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 28.3 m -126.44 155.19 36.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.245 -179.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 41.3 mttt -111.55 -33.37 6.39 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.905 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 61.87 77.38 0.33 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.865 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -175.51 -77.56 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.097 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 59.14 -172.45 0.11 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.871 179.869 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -151.63 169.45 22.1 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.838 -179.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.526 ' O ' HG13 ' A' ' 106' ' ' VAL . 10.8 p -87.06 59.09 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.984 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -101.69 124.36 47.2 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.866 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -140.57 95.79 2.92 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.819 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.453 HG23 ' N ' ' A' ' 110' ' ' GLU . 12.1 m -141.8 -47.18 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.138 179.88 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . 0.453 ' N ' HG23 ' A' ' 109' ' ' VAL . 4.1 mt-10 -124.88 145.19 49.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.902 179.974 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -176.16 78.07 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.922 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.199 -0.905 . . . . 0.0 110.899 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.487 1.401 0 CA-C-O 120.921 0.391 . . . . 0.0 111.209 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . 0.405 ' HB3' ' CD1' ' A' ' 23' ' ' LEU . 0.1 OUTLIER -62.35 132.93 54.24 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.694 179.942 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -124.45 130.52 52.62 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.297 -179.666 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 39.6 mt -136.2 124.82 37.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.667 179.621 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -134.45 160.74 37.04 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.941 0.401 . . . . 0.0 111.255 -179.962 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.415 ' HB3' ' HB2' ' A' ' 40' ' ' LEU . 21.9 p -162.67 145.75 11.09 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.39 -179.474 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.47 30.05 4.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.404 -179.47 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -142.39 -53.87 0.42 Allowed 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.806 179.579 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 2.1 mpp? -109.23 -176.68 3.09 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.803 179.8 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -115.72 168.74 9.76 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.666 179.754 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.465 HG22 ' HG3' ' A' ' 16' ' ' ARG . 5.1 mm -90.5 114.01 27.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 121.043 0.449 . . . . 0.0 111.143 -179.385 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 13.6 p -99.8 157.72 33.4 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.911 179.632 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -61.7 -15.76 44.21 Favored 'Trans proline' 0 C--N 1.343 0.265 0 C-N-CA 122.482 2.121 . . . . 0.0 111.88 179.056 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -83.15 -41.06 18.94 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-O 121.019 0.438 . . . . 0.0 110.263 179.181 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.45 ' O ' HG23 ' A' ' 19' ' ' VAL . 42.2 mt -72.79 -29.09 28.73 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.285 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 178.801 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.465 ' HG3' HG22 ' A' ' 11' ' ' ILE . 75.9 mtt180 -73.45 -47.33 42.35 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.521 178.667 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -67.15 -38.46 85.54 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.89 179.149 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.491 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 75.5 t60 -59.53 -62.7 1.68 Allowed 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.872 -0.418 . . . . 0.0 109.872 179.17 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.715 HG13 HD11 ' A' ' 77' ' ' ILE . 22.6 t -60.82 -47.57 92.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.735 178.95 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.669 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -56.68 -44.84 81.85 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 111.855 0.317 . . . . 0.0 111.855 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.491 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 1.1 p30 -59.34 -32.97 70.58 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.044 0.449 . . . . 0.0 110.408 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 31.3 mmt180 -75.13 -28.85 60.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.859 179.793 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.681 HD21 HG12 ' A' ' 19' ' ' VAL . 3.5 mt -69.17 -54.43 14.91 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.96 0.41 . . . . 0.0 110.659 179.653 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -58.51 -25.93 62.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.103 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.3 -32.3 43.48 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.268 0.556 . . . . 0.0 109.875 178.965 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.615 ' HB3' ' HB2' ' A' ' 29' ' ' TRP . 31.6 mt -81.07 60.31 4.19 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.673 179.757 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -59.61 -76.3 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.536 -179.412 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.437 ' HG2' ' CD1' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -52.59 -21.84 4.33 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.084 0.468 . . . . 0.0 112.027 -179.6 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.615 ' HB2' ' HB3' ' A' ' 26' ' ' LEU . 50.2 m95 -85.5 -57.03 3.23 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.27 -178.623 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.419 ' CG ' HD12 ' A' ' 33' ' ' LEU . 2.2 tt0 -91.97 33.42 1.06 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.767 0.317 . . . . 0.0 111.04 -179.905 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.404 ' CG2' ' N ' ' A' ' 32' ' ' HIS . 0.6 OUTLIER -81.93 -46.68 13.71 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.263 -179.646 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . 0.404 ' N ' ' CG2' ' A' ' 31' ' ' THR . 35.8 m170 -84.47 -26.9 27.86 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.545 -179.394 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.697 HD23 HG22 ' A' ' 55' ' ' THR . 58.7 mt -50.27 146.65 4.93 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.029 -179.845 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.434 HD11 ' HG3' ' A' ' 56' ' ' PRO . 18.3 mt -133.13 105.43 8.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-O 120.759 0.314 . . . . 0.0 111.693 -179.67 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 51.7 78.78 0.38 Allowed Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.589 179.289 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.484 ' HB3' HG23 ' A' ' 53' ' ' ILE . 95.2 Cg_endo -81.88 161.38 18.59 Favored 'Trans proline' 0 N--CA 1.462 -0.35 0 C-N-CA 122.779 2.319 . . . . 0.0 112.241 179.61 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 1.7 t-160 -136.68 128.77 29.59 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.918 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.59 ' N ' HD12 ' A' ' 38' ' ' ILE . 3.7 mp -120.61 137.52 54.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.2 179.949 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 4.3 mp -114.7 148.28 17.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.877 179.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.415 ' HB2' ' HB3' ' A' ' 6' ' ' SER . 10.0 mt -123.34 127.5 48.59 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.939 0.4 . . . . 0.0 111.018 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -125.06 -170.97 2.26 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.645 179.918 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.471 ' HA ' ' HA ' ' A' ' 47' ' ' PHE . 2.7 ttmm -171.35 145.12 2.09 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.202 0.525 . . . . 0.0 111.039 -179.855 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.46 ' N ' ' HG2' ' A' ' 42' ' ' LYS . 2.2 mm-40 -130.1 166.28 27.64 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.015 178.816 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . 0.429 ' HD2' ' HB3' ' A' ' 43' ' ' GLU . 80.1 Cg_exo -48.72 -19.84 2.38 Favored 'Trans proline' 0 N--CA 1.463 -0.28 0 C-N-CA 121.837 1.691 . . . . 0.0 112.622 -178.946 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -85.38 -77.21 0.3 Allowed 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.004 179.078 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . 0.463 ' HA3' ' HA ' ' A' ' 67' ' ' GLU . . . -142.37 -153.69 5.97 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.629 -179.409 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.471 ' HA ' ' HA ' ' A' ' 42' ' ' LYS . 21.6 m-85 -109.29 150.5 27.88 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-O 121.709 0.766 . . . . 0.0 112.583 -179.354 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.612 HG22 ' CG ' ' A' ' 65' ' ' LYS . 59.8 t -124.37 140.39 47.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 114.397 -1.274 . . . . 0.0 110.254 179.955 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -131.62 124.98 31.07 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.66 0.267 . . . . 0.0 110.812 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -119.13 148.26 43.26 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.443 179.679 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.564 ' N ' HD11 ' A' ' 76' ' ' LEU . . . -147.11 144.38 28.99 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.981 0.42 . . . . 0.0 112.063 179.84 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.0 m -136.75 129.29 30.26 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.704 179.163 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.669 ' O ' HG13 ' A' ' 59' ' ' VAL . 9.0 mt -131.13 140.93 47.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-O 121.053 0.454 . . . . 0.0 111.716 -179.23 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -100.6 140.86 34.27 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.891 179.321 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.697 HG22 HD23 ' A' ' 33' ' ' LEU . 5.9 p -133.8 156.41 79.42 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.002 179.448 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.434 ' HG3' HD11 ' A' ' 34' ' ' ILE . 19.6 Cg_exo -65.24 -11.04 28.21 Favored 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 122.244 1.962 . . . . 0.0 112.659 -179.572 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 53.3 m-80 -125.92 21.4 7.55 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 111.75 0.278 . . . . 0.0 111.75 -179.605 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 143.95 -166.73 26.97 Favored Glycine 0 C--N 1.331 0.297 0 C-N-CA 120.258 -0.972 . . . . 0.0 113.181 179.627 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.669 HG13 ' O ' ' A' ' 53' ' ' ILE . 16.6 t -140.13 143.63 29.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 120.68 0.276 . . . . 0.0 110.986 -179.921 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.525 HD23 ' HB2' ' A' ' 83' ' ' GLN . 6.5 mp -118.01 152.16 36.05 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.919 0.39 . . . . 0.0 111.447 -179.676 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 19.6 t -140.8 147.31 22.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.881 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.413 ' HB1' ' HB2' ' A' ' 79' ' ' LYS . . . -153.91 156.73 38.06 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.235 0.54 . . . . 0.0 111.637 -179.724 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.408 ' HA ' HD12 ' A' ' 76' ' ' LEU . 26.5 p -144.4 158.22 43.86 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.738 -179.341 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.75 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -152.91 105.28 0.27 Allowed Glycine 0 C--N 1.334 0.418 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.731 179.638 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.612 ' CG ' HG22 ' A' ' 48' ' ' VAL . 3.0 mptt -107.1 44.93 1.02 Allowed 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -178.905 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.651 ' ND1' HG21 ' A' ' 71' ' ' THR . 12.6 t-80 -76.21 156.46 33.58 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.802 0.335 . . . . 0.0 110.233 178.596 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.463 ' HA ' ' HA3' ' A' ' 46' ' ' GLY . 5.0 mt-10 -61.38 -26.45 67.84 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.781 0.324 . . . . 0.0 111.132 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -98.32 122.13 41.12 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.034 0.445 . . . . 0.0 111.372 -179.48 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.681 ' HE3' HD11 ' A' ' 73' ' ' ILE . 0.8 OUTLIER -47.93 -49.64 29.5 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.817 179.901 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 18.4 m-85 -65.96 -37.02 84.92 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.587 -179.158 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.651 HG21 ' ND1' ' A' ' 66' ' ' HIS . 97.9 m -64.59 -41.52 96.19 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.695 0.283 . . . . 0.0 110.559 -179.901 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.75 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -61.55 -47.66 84.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.522 179.514 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.681 HD11 ' HE3' ' A' ' 69' ' ' MET . 14.1 mt -60.93 -46.34 96.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.584 179.553 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -64.44 -40.73 96.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.55 179.624 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -65.73 -44.53 85.72 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.604 179.795 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.564 HD11 ' N ' ' A' ' 51' ' ' ALA . 0.3 OUTLIER -53.23 -59.39 4.62 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.368 179.402 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.715 HD11 HG13 ' A' ' 19' ' ' VAL . 44.3 mt -56.12 -29.88 28.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 N-CA-C 110.183 -0.303 . . . . 0.0 110.183 179.023 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -58.72 -38.2 77.83 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.446 0.641 . . . . 0.0 109.668 178.45 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.413 ' HB2' ' HB1' ' A' ' 62' ' ' ALA . 0.0 OUTLIER -73.77 -29.17 62.05 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.01 178.937 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.474 HD12 ' HA ' ' A' ' 77' ' ' ILE . 94.8 mt -62.06 -48.81 78.57 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 107.759 -1.2 . . . . 0.0 107.759 177.379 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.455 ' O ' ' CZ3' ' A' ' 29' ' ' TRP . 11.9 tt0 -62.68 -44.34 96.51 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 114.514 -1.221 . . . . 0.0 110.481 177.76 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.68 -32.13 73.15 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.028 -179.367 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.525 ' HB2' HD23 ' A' ' 60' ' ' LEU . 25.0 mt-30 -74.91 -41.75 59.11 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.123 0.487 . . . . 0.0 110.38 179.788 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.496 ' HA ' HD12 ' A' ' 87' ' ' LEU . 0.4 OUTLIER -65.11 -32.15 73.71 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.772 179.682 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.465 ' O ' ' HG3' ' A' ' 88' ' ' GLN . 55.9 t30 -61.37 -33.6 73.91 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.549 -178.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.495 ' HA ' ' CE1' ' A' ' 89' ' ' HIS . 21.6 mttm -77.11 -27.45 54.05 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.335 -179.753 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.496 HD12 ' HA ' ' A' ' 84' ' ' LEU . 47.8 mt -72.29 -23.13 61.14 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 -178.752 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.465 ' HG3' ' O ' ' A' ' 85' ' ' ASN . 1.8 pt20 -78.24 -102.8 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 111.719 0.266 . . . . 0.0 111.719 -178.933 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.495 ' CE1' ' HA ' ' A' ' 86' ' ' LYS . 10.6 m-70 62.54 -72.69 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.007 0.432 . . . . 0.0 111.119 -179.226 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.46 ' N ' ' O ' ' A' ' 88' ' ' GLN . 40.4 mttm -69.91 -68.34 0.42 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.075 -179.266 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 143.76 -162.99 27.71 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.425 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -163.74 118.3 1.56 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.813 0.339 . . . . 0.0 110.9 179.942 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -98.29 38.09 1.37 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.156 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -92.77 109.36 20.79 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.929 -179.983 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.14 169.33 8.94 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.883 179.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -99.02 34.67 2.06 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.062 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -83.69 97.21 8.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.098 -179.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -148.37 160.83 42.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.949 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -139.43 100.74 4.06 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.873 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.489 HG22 ' N ' ' A' ' 101' ' ' LYS . 10.0 p -160.19 158.63 2.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.132 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.489 ' N ' HG22 ' A' ' 100' ' ' VAL . 0.0 OUTLIER -173.77 -36.41 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.179 179.975 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . 0.415 ' N ' ' HG2' ' A' ' 101' ' ' LYS . 0.7 OUTLIER 61.35 77.2 0.34 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.877 0.37 . . . . 0.0 110.971 -179.978 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -120.63 82.18 1.87 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.084 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -111.45 44.99 1.25 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.93 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.682 ' O ' HG12 ' A' ' 106' ' ' VAL . 52.2 t80 63.42 139.93 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.903 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.682 HG12 ' O ' ' A' ' 105' ' ' PHE . 9.5 p 51.51 163.69 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.92 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . 0.483 ' N ' HG22 ' A' ' 106' ' ' VAL . 5.3 tt0 67.77 129.55 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.038 -179.793 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -160.13 -64.3 0.07 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.85 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 5.7 m -142.35 149.14 19.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.095 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 60.83 -172.22 0.14 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.889 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -130.43 -65.38 0.81 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.903 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.212 -0.899 . . . . 0.0 110.842 -179.955 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 6.2 t . . . . . 0 N--CA 1.487 1.417 0 CA-C-O 120.872 0.367 . . . . 0.0 111.209 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . 0.654 ' HG3' HD11 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -145.12 169.38 18.27 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.858 -179.944 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -122.11 120.67 34.94 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.879 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.469 HG23 ' O ' ' A' ' 4' ' ' ILE . 12.5 tt -125.58 124.42 66.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.731 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 3.0 p -134.51 163.73 29.05 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.832 0.348 . . . . 0.0 111.247 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 42.3 p -163.3 131.43 3.72 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.348 -179.5 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 11.7 mttt -100.7 42.39 1.12 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.914 -179.718 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -140.06 -46.14 0.43 Allowed 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.505 179.572 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 10.0 mtm -134.67 -178.87 5.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.468 179.664 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -89.93 164.35 14.6 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.673 179.863 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.0 mm -90.79 116.95 33.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.936 0.398 . . . . 0.0 110.859 -179.669 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 16.0 p -100.6 146.6 32.33 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.091 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_exo -55.33 -21.22 28.36 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.36 2.04 . . . . 0.0 111.652 179.12 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -74.72 -42.33 58.53 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 121.197 0.522 . . . . 0.0 110.287 179.331 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 38.8 mt -72.31 -30.42 35.21 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.305 178.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.438 ' O ' ' CB ' ' A' ' 20' ' ' ALA . 7.9 mtt180 -73.2 -46.41 50.6 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.602 178.666 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 47.5 tt0 -66.79 -37.0 83.7 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.641 179.106 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.479 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 50.2 t60 -59.88 -65.28 0.7 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.854 0.359 . . . . 0.0 110.067 179.014 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.646 HG12 HD21 ' A' ' 23' ' ' LEU . 21.6 t -60.18 -46.5 94.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.97 179.168 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.645 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -57.26 -45.34 84.09 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 179.95 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.479 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 1.5 p30 -59.46 -31.56 69.43 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 120.809 -0.356 . . . . 0.0 110.64 -179.857 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 16.6 mmt180 -74.75 -28.6 60.83 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.81 179.726 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.654 HD11 ' HG3' ' A' ' 2' ' ' MET . 1.6 mt -68.32 -51.61 42.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.935 0.398 . . . . 0.0 110.362 179.326 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.29 -24.13 63.02 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.823 179.592 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 7.0 tptp -77.43 -34.05 54.73 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.29 179.339 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.726 HD23 ' HE1' ' A' ' 29' ' ' TRP . 0.5 OUTLIER -81.33 55.31 2.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.715 179.37 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -116.01 -1.43 12.51 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.59 -179.714 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -70.92 -10.55 59.87 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.8 0.333 . . . . 0.0 111.359 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.898 ' CD2' HD21 ' A' ' 84' ' ' LEU . 62.1 m95 -84.67 -179.88 7.22 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.134 -179.908 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -114.58 -14.99 12.05 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.565 -179.82 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.527 ' O ' HG23 ' A' ' 31' ' ' THR . 15.1 t -76.57 111.43 12.04 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.151 0.501 . . . . 0.0 110.556 179.694 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 35.6 m-70 -60.28 169.23 1.7 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.32 -179.565 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 1.069 HD23 HG21 ' A' ' 53' ' ' ILE . 2.2 mp -143.22 130.15 20.55 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.174 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.8 mp -121.89 103.15 13.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 121.439 0.638 . . . . 0.0 112.135 -179.167 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 50.43 78.62 0.39 Allowed Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 114.887 -1.052 . . . . 0.0 112.48 178.773 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.513 ' HB3' HG23 ' A' ' 53' ' ' ILE . 94.8 Cg_endo -83.38 133.31 6.25 Favored 'Trans proline' 0 N--CA 1.459 -0.532 0 C-N-CA 122.665 2.244 . . . . 0.0 111.132 178.673 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . 0.453 ' C ' HD12 ' A' ' 38' ' ' ILE . 0.7 OUTLIER -105.07 127.36 52.85 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.065 0.46 . . . . 0.0 111.959 -179.01 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.635 ' N ' HD12 ' A' ' 38' ' ' ILE . 3.3 mp -120.16 134.09 64.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.062 179.168 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 39.1 mt -116.27 148.42 19.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.42 -179.635 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.2 mt -123.79 127.53 48.22 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.713 179.72 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -125.54 -170.52 2.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.712 -179.916 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.486 ' HA ' ' HA ' ' A' ' 47' ' ' PHE . 0.0 OUTLIER -171.56 145.43 2.04 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.243 0.544 . . . . 0.0 110.943 -179.833 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.449 ' HB3' ' HD2' ' A' ' 44' ' ' PRO . 2.8 mm-40 -130.38 164.9 38.01 Favored Pre-proline 0 C--N 1.323 -0.581 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.197 179.099 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . 0.449 ' HD2' ' HB3' ' A' ' 43' ' ' GLU . 3.2 Cg_endo -46.79 -21.82 1.64 Allowed 'Trans proline' 0 N--CA 1.462 -0.355 0 C-N-CA 122.239 1.959 . . . . 0.0 112.363 -179.282 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 45.5 tp60 -84.27 -78.6 0.23 Allowed 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.769 179.105 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . 0.439 ' HA3' ' HA ' ' A' ' 67' ' ' GLU . . . -141.07 -152.72 5.8 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.671 -179.288 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.486 ' HA ' ' HA ' ' A' ' 42' ' ' LYS . 19.6 m-85 -110.37 151.06 27.91 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.731 0.777 . . . . 0.0 112.819 -179.249 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.556 HG22 ' HG2' ' A' ' 65' ' ' LYS . 67.0 t -123.89 140.54 47.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 114.393 -1.276 . . . . 0.0 110.251 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.423 ' O ' ' HA ' ' A' ' 63' ' ' SER . . . -132.18 124.83 29.8 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.642 0.258 . . . . 0.0 111.003 -179.853 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -117.19 147.96 42.03 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.287 179.629 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.661 ' N ' HD11 ' A' ' 76' ' ' LEU . . . -144.97 142.74 30.08 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.998 0.428 . . . . 0.0 111.852 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.0 m -135.02 130.18 35.27 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.848 179.324 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 1.069 HG21 HD23 ' A' ' 33' ' ' LEU . 16.1 mt -130.52 137.22 56.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.06 0.457 . . . . 0.0 111.464 -179.352 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -101.94 137.19 40.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.749 179.549 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 6.3 p -132.5 161.2 64.68 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.302 179.576 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_exo -68.12 -9.31 25.37 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.43 2.087 . . . . 0.0 112.582 -179.559 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -117.23 -3.71 11.46 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 111.744 0.275 . . . . 0.0 111.744 -179.773 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 158.33 -166.29 34.15 Favored Glycine 0 C--N 1.331 0.304 0 C-N-CA 120.366 -0.921 . . . . 0.0 112.754 179.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.668 HG13 ' O ' ' A' ' 53' ' ' ILE . 21.2 t -134.02 140.87 45.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 120.845 0.355 . . . . 0.0 111.161 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.565 HD21 HD21 ' A' ' 87' ' ' LEU . 11.0 mt -115.54 156.91 24.88 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.027 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.412 ' O ' ' NE2' ' A' ' 83' ' ' GLN . 21.1 t -140.31 149.69 21.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.008 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.418 ' O ' HD12 ' A' ' 76' ' ' LEU . . . -154.5 155.56 35.09 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.19 0.519 . . . . 0.0 111.544 -179.799 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.423 ' HA ' ' O ' ' A' ' 49' ' ' ALA . 0.5 OUTLIER -145.45 158.08 43.9 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.759 -179.277 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.43 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -151.88 109.19 0.41 Allowed Glycine 0 C--N 1.331 0.257 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.628 179.505 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.556 ' HG2' HG22 ' A' ' 48' ' ' VAL . 1.0 OUTLIER -109.24 45.02 1.09 Allowed 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -178.861 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 13.0 t-80 -76.22 156.01 33.95 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.784 0.325 . . . . 0.0 110.367 178.651 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.439 ' HA ' ' HA3' ' A' ' 46' ' ' GLY . 0.3 OUTLIER -61.53 -27.52 68.67 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.723 0.297 . . . . 0.0 111.36 -179.84 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -98.2 121.47 40.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.012 0.434 . . . . 0.0 111.508 -179.39 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -47.95 -50.42 27.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.813 179.865 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 43.0 m-85 -66.85 -44.14 81.79 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.775 -179.016 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 16.8 m -63.96 -42.03 97.39 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.801 0.334 . . . . 0.0 110.883 -179.701 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.43 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -61.5 -47.99 83.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.715 179.611 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.621 HG21 HG22 ' A' ' 19' ' ' VAL . 16.4 mt -58.67 -44.28 89.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 120.96 0.41 . . . . 0.0 110.44 179.636 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -63.41 -36.11 82.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.362 179.373 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -64.85 -41.67 95.51 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.156 -0.475 . . . . 0.0 109.856 179.182 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.661 HD11 ' N ' ' A' ' 51' ' ' ALA . 0.2 OUTLIER -54.87 -59.9 4.1 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 178.878 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.65 HG13 HD23 ' A' ' 76' ' ' LEU . 6.9 mt -56.25 -30.48 30.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 110.013 -0.365 . . . . 0.0 110.013 178.727 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -59.85 -31.74 70.04 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-O 121.304 0.573 . . . . 0.0 110.157 178.196 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 7.2 mmtt -82.85 -24.87 33.06 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.485 179.162 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.574 HD13 HD11 ' A' ' 53' ' ' ILE . 93.4 mt -64.3 -47.63 78.71 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 107.574 -1.269 . . . . 0.0 107.574 177.111 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.575 ' O ' HD12 ' A' ' 84' ' ' LEU . 3.4 tt0 -59.31 -44.69 92.52 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 114.619 -1.173 . . . . 0.0 110.815 177.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -69.25 -37.08 77.76 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.706 -179.591 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.412 ' NE2' ' O ' ' A' ' 61' ' ' VAL . 36.6 mt-30 -78.19 -48.55 15.61 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 -178.665 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.967 HD13 ' N ' ' A' ' 85' ' ' ASN . 0.0 OUTLIER -63.7 -14.8 55.54 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 120.672 -0.411 . . . . 0.0 111.082 -179.402 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.967 ' N ' HD13 ' A' ' 84' ' ' LEU . 0.2 OUTLIER -67.73 -28.23 67.47 Favored 'General case' 0 N--CA 1.457 -0.099 0 CA-C-O 121.152 0.501 . . . . 0.0 110.1 178.762 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.449 ' HA ' ' CD2' ' A' ' 89' ' ' HIS . 4.0 mmtm -71.04 -9.54 58.2 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.323 -179.757 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.565 HD21 HD21 ' A' ' 60' ' ' LEU . 14.7 mt -69.58 -26.45 64.48 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.861 0.362 . . . . 0.0 110.94 179.744 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -75.92 -10.09 59.14 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.329 -179.854 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.449 ' CD2' ' HA ' ' A' ' 86' ' ' LYS . 4.9 m170 -85.89 -60.76 1.92 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.983 0.421 . . . . 0.0 110.734 179.728 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 42.92 -166.8 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.613 -179.878 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -117.27 -17.46 5.73 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.806 -179.741 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 61.47 103.37 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.904 0.383 . . . . 0.0 110.944 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -161.12 120.62 2.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.081 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 2.8 ptt180 -146.75 83.66 1.59 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.97 -179.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -173.85 -171.98 0.7 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.874 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -86.6 -48.62 8.17 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.057 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -136.17 178.31 7.16 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.1 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . 0.418 HG23 ' H ' ' A' ' 99' ' ' SER . 1.4 t -129.55 -52.95 1.17 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.956 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . 0.418 ' H ' HG23 ' A' ' 98' ' ' THR . 0.1 OUTLIER -165.91 -60.74 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.863 179.982 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 21.5 t -139.31 116.94 11.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.171 -179.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -161.99 179.33 8.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.928 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -171.63 142.2 1.56 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.876 179.935 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -102.63 132.56 48.65 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.167 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 28.9 m-20 -96.44 92.4 6.28 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.92 179.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 38.2 t80 -69.65 -48.11 61.01 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.916 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 21.5 t 63.82 139.19 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.111 179.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -100.59 -179.82 4.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.867 -179.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 66.39 -71.82 0.09 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.126 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 21.4 t 64.26 135.52 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.16 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -98.17 -176.67 3.49 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.823 179.973 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -117.14 -40.99 3.04 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.894 179.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.314 -0.85 . . . . 0.0 110.924 179.855 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . 0.425 ' O ' HG23 ' A' ' 1' ' ' THR . 2.9 t . . . . . 0 N--CA 1.486 1.342 0 CA-C-O 120.857 0.361 . . . . 0.0 111.225 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . 0.588 ' CE ' ' HB2' ' A' ' 20' ' ' ALA . 1.2 ptt? -59.3 149.04 29.95 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.867 179.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -121.95 128.55 51.63 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.107 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 36.9 mt -129.13 124.31 60.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.718 179.663 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -135.63 161.01 36.73 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.042 0.449 . . . . 0.0 111.397 -179.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 21.6 p -163.67 141.02 7.25 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.325 -179.682 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -100.36 27.74 5.5 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.183 -179.396 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -142.38 -45.34 0.33 Allowed 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.791 179.625 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 5.0 mpp? -113.23 -176.23 2.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.66 179.764 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -118.85 165.63 13.8 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.503 179.705 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 5.7 mm -89.73 109.3 20.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 121.149 0.499 . . . . 0.0 111.101 -179.413 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 16.1 p -98.19 159.09 31.54 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 115.428 -0.806 . . . . 0.0 110.986 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.431 ' HA ' ' HG2' ' A' ' 16' ' ' ARG . 23.6 Cg_exo -62.54 -13.5 33.84 Favored 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 122.579 2.186 . . . . 0.0 111.919 179.006 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -86.59 -41.93 13.89 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.959 0.409 . . . . 0.0 110.597 179.483 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 25.5 mt -71.93 -31.52 40.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.844 -0.616 . . . . 0.0 109.587 179.44 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.449 ' O ' ' HE1' ' A' ' 2' ' ' MET . 26.6 ptt180 -72.93 -44.24 61.43 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.485 178.796 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.401 ' N ' ' CG ' ' A' ' 16' ' ' ARG . 1.9 tm0? -65.62 -38.7 90.19 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.635 179.078 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.581 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 78.2 t60 -60.36 -50.05 75.16 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.48 -0.488 . . . . 0.0 109.685 178.787 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.704 ' O ' ' HG3' ' A' ' 22' ' ' ARG . 79.7 t -63.64 -44.01 98.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 177.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.684 ' HA ' ' HB2' ' A' ' 23' ' ' LEU . . . -63.24 -37.06 85.76 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.907 -0.317 . . . . 0.0 111.783 179.915 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.581 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 0.8 OUTLIER -60.3 -44.03 95.79 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 -179.611 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.784 ' HD3' HG21 ' A' ' 77' ' ' ILE . 1.6 ppt_? -74.75 -16.63 60.72 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.728 0.775 . . . . 0.0 109.01 178.372 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.684 ' HB2' ' HA ' ' A' ' 20' ' ' ALA . 0.2 OUTLIER -70.2 -63.78 1.02 Allowed 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 114.387 -1.279 . . . . 0.0 109.918 178.858 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.01 -21.14 65.94 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.185 179.338 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.12 -29.81 38.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.993 0.425 . . . . 0.0 110.935 179.789 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.84 HD23 ' CD1' ' A' ' 29' ' ' TRP . 9.1 mt -79.19 60.52 3.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.028 -179.582 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.434 ' HA ' ' HG2' ' A' ' 30' ' ' GLN . 0.1 OUTLIER -65.93 -69.52 0.29 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.601 -179.721 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.402 ' HG3' ' CD1' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -51.08 -23.79 3.4 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.281 0.562 . . . . 0.0 111.736 -179.683 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.84 ' CD1' HD23 ' A' ' 26' ' ' LEU . 73.1 m95 -85.14 -42.03 15.13 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.311 -0.859 . . . . 0.0 112.591 -178.754 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.434 ' HG2' ' HA ' ' A' ' 27' ' ' GLU . 0.5 OUTLIER -68.35 69.62 0.15 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.964 0.411 . . . . 0.0 110.755 -179.924 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.456 HG23 ' N ' ' A' ' 32' ' ' HIS . 9.5 t -78.42 -47.63 17.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.2 -179.759 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . 0.456 ' N ' HG23 ' A' ' 31' ' ' THR . 69.0 m-70 -152.1 -89.6 0.06 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.357 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.89 HD22 HG21 ' A' ' 53' ' ' ILE . 0.9 OUTLIER 60.86 151.44 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.131 0 N-CA-C 110.199 -0.297 . . . . 0.0 110.199 -179.45 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.5 HD11 ' HD3' ' A' ' 56' ' ' PRO . 3.6 mp -140.01 109.72 3.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 121.109 0.48 . . . . 0.0 111.986 -179.749 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 54.49 73.18 0.93 Allowed Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 115.554 -0.748 . . . . 0.0 112.159 179.03 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -75.5 151.62 37.55 Favored 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 122.45 2.1 . . . . 0.0 111.433 178.871 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -134.26 133.25 40.6 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.202 0.525 . . . . 0.0 111.907 -179.14 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.443 ' CD1' ' HB1' ' A' ' 51' ' ' ALA . 13.9 mm -121.47 132.21 71.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.64 179.531 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 37.9 mt -119.69 146.74 23.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.98 -179.883 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.647 HD22 HD11 ' A' ' 73' ' ' ILE . 2.2 mt -124.35 126.36 45.87 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.013 0.435 . . . . 0.0 110.842 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -123.02 -173.17 2.65 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.421 179.615 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.412 ' HA ' ' HA ' ' A' ' 47' ' ' PHE . 81.9 tttt -163.55 139.28 6.6 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.386 0.612 . . . . 0.0 111.285 -179.764 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -130.85 158.79 73.95 Favored Pre-proline 0 C--N 1.323 -0.554 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.382 179.137 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_exo -52.05 -24.31 19.4 Favored 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 121.957 1.772 . . . . 0.0 112.489 179.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.26 -6.03 57.12 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.506 -0.77 . . . . 0.0 112.689 -179.107 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 148.86 -161.02 28.59 Favored Glycine 0 C--O 1.223 -0.542 0 C-N-CA 120.299 -0.953 . . . . 0.0 112.159 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.423 ' CD1' ' N ' ' A' ' 47' ' ' PHE . 18.0 m-85 -111.35 155.11 23.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.516 0.674 . . . . 0.0 111.989 -179.908 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.781 HG22 ' CG ' ' A' ' 65' ' ' LYS . 94.0 t -127.41 139.44 51.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 114.844 -1.071 . . . . 0.0 111.01 -179.24 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.408 ' O ' ' HA ' ' A' ' 63' ' ' SER . . . -130.65 122.41 27.33 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.447 179.4 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -119.61 147.04 44.98 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.808 0.337 . . . . 0.0 111.115 -179.616 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.637 ' N ' HD11 ' A' ' 76' ' ' LEU . . . -143.56 139.43 29.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.207 179.719 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 3.0 m -135.95 130.54 33.84 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.294 179.674 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.89 HG21 HD22 ' A' ' 33' ' ' LEU . 23.4 mt -132.38 134.89 58.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 120.873 0.368 . . . . 0.0 111.215 -179.753 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.451 ' O ' HD12 ' A' ' 34' ' ' ILE . 9.3 m120 -103.02 119.41 38.8 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.978 179.625 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.508 HG22 HD23 ' A' ' 33' ' ' LEU . 33.3 p -112.44 157.09 41.11 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.406 179.541 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.5 ' HD3' HD11 ' A' ' 34' ' ' ILE . 24.2 Cg_exo -63.3 -14.25 40.89 Favored 'Trans proline' 0 C--N 1.342 0.227 0 C-N-CA 122.521 2.148 . . . . 0.0 112.643 -179.77 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 59.6 m-80 -117.77 24.17 11.23 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.463 -179.707 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 134.93 -167.58 23.98 Favored Glycine 0 C--N 1.331 0.262 0 C-N-CA 120.48 -0.867 . . . . 0.0 112.815 179.797 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.676 HG13 ' O ' ' A' ' 53' ' ' ILE . 14.1 t -138.92 142.47 34.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 120.703 0.287 . . . . 0.0 110.956 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 16.3 mt -116.5 151.21 36.56 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.033 -179.79 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 15.0 p -139.47 148.18 23.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.086 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.536 ' O ' HD12 ' A' ' 76' ' ' LEU . . . -154.5 149.59 26.9 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.132 0.491 . . . . 0.0 111.559 -179.721 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.408 ' HA ' ' O ' ' A' ' 49' ' ' ALA . 6.3 m -143.99 158.26 43.82 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.662 -179.437 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.658 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -150.48 105.34 0.29 Allowed Glycine 0 C--N 1.332 0.359 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.659 179.456 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.781 ' CG ' HG22 ' A' ' 48' ' ' VAL . 0.2 OUTLIER -103.75 45.04 0.98 Allowed 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.14 0.422 . . . . 0.0 112.14 -178.904 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.461 ' CE1' HG21 ' A' ' 71' ' ' THR . 12.5 t-80 -76.27 155.93 33.91 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.62 -0.264 . . . . 0.0 110.437 178.846 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -60.31 -28.0 67.77 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.587 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 7.2 t0 -98.29 120.13 38.17 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.957 0.408 . . . . 0.0 111.526 -179.308 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 24.2 ttt -48.05 -47.24 33.83 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.608 179.86 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -66.28 -41.21 90.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.101 -179.584 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.461 HG21 ' CE1' ' A' ' 66' ' ' HIS . 76.8 m -65.22 -37.22 86.6 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.416 -0.357 . . . . 0.0 110.613 179.779 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.658 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -63.08 -50.77 69.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.689 179.626 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.647 HD11 HD22 ' A' ' 40' ' ' LEU . 7.8 mt -62.08 -41.98 93.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 179.262 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -63.86 -39.86 95.2 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 178.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.439 ' HA ' ' HB3' ' A' ' 78' ' ' ASN . 5.3 mt-10 -66.88 -41.11 87.8 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.39 179.207 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.637 HD11 ' N ' ' A' ' 51' ' ' ALA . 0.2 OUTLIER -53.2 -61.65 2.16 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 178.838 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.784 HG21 ' HD3' ' A' ' 22' ' ' ARG . 52.2 mt -54.96 -30.27 23.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 178.502 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.439 ' HB3' ' HA ' ' A' ' 75' ' ' GLU . 0.0 OUTLIER -57.77 -38.48 75.51 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.065 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.14 -30.92 55.31 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 114.704 -1.135 . . . . 0.0 109.839 178.592 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.799 ' O ' HD12 ' A' ' 84' ' ' LEU . 67.7 mt -64.74 -49.15 71.94 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 107.987 -1.116 . . . . 0.0 107.987 177.608 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -59.71 -48.73 80.52 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.151 177.633 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 50.5 mtt-85 -64.3 -25.57 68.11 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.962 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -74.63 -48.57 25.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.354 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.799 HD12 ' O ' ' A' ' 80' ' ' LEU . 1.0 OUTLIER -64.5 -29.16 70.2 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.497 179.64 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 31.1 t-20 -61.54 -33.29 73.58 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.024 -0.535 . . . . 0.0 109.912 179.719 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.86 -26.49 61.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.362 179.423 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.19 -46.79 82.39 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.375 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 54.9 mt-30 -77.96 -13.19 59.97 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.864 179.302 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 81.0 m-70 62.57 -79.16 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.318 179.768 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 1.2 mmtt 61.46 155.17 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.718 -179.775 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 173.92 40.71 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.654 -0.784 . . . . 0.0 112.564 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -176.1 90.62 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.808 0.337 . . . . 0.0 110.94 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -59.33 112.98 1.94 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.132 -179.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 22.9 mtp180 -67.71 -44.4 77.74 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.937 179.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -84.19 135.53 34.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.93 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -109.55 34.7 3.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.046 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -128.46 161.57 29.21 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.114 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 7.1 m -147.34 -57.47 0.25 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.933 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 20.5 m -123.8 125.72 45.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.966 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.534 HG13 ' O ' ' A' ' 100' ' ' VAL . 12.3 p -104.31 56.87 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.075 -179.975 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 59.92 27.06 16.37 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.995 179.988 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 56.85 103.16 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.031 179.986 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -69.89 -30.44 67.88 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.078 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 61.86 103.0 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.938 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 21.6 p90 -177.11 135.35 0.2 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.849 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.477 ' O ' HG13 ' A' ' 106' ' ' VAL . 11.6 p -176.08 120.8 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.177 179.965 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 62.75 120.73 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.923 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 46.27 -169.29 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.247 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 21.5 t -107.23 149.25 10.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.05 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -104.3 -31.79 9.39 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.843 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -71.38 79.53 0.75 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.887 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.219 -0.896 . . . . 0.0 110.916 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . 0.508 ' O ' ' O ' ' A' ' 2' ' ' MET . 48.0 p . . . . . 0 N--CA 1.486 1.336 0 CA-C-O 120.563 0.221 . . . . 0.0 111.292 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . 0.512 ' HG2' ' O ' ' A' ' 2' ' ' MET . 0.0 OUTLIER 51.03 126.88 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 121.444 0.64 . . . . 0.0 111.985 -179.911 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -120.02 97.58 5.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.276 -179.58 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.565 ' CG2' HD11 ' A' ' 40' ' ' LEU . 34.3 mt -97.04 124.89 50.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.645 179.455 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 p -134.44 159.9 39.64 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.953 0.406 . . . . 0.0 111.239 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.609 ' HB3' HD12 ' A' ' 40' ' ' LEU . 21.8 p -163.42 145.29 9.65 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.475 -179.766 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 20.8 mmtp -103.41 -6.04 22.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.576 -179.663 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -99.97 -28.21 13.19 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 120.747 0.308 . . . . 0.0 111.209 -179.848 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 37.9 mtm -140.14 -175.52 4.27 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.071 -179.874 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 -111.06 166.93 10.65 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.653 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 5.2 mm -89.97 108.98 20.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-O 121.101 0.477 . . . . 0.0 111.066 -179.567 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 17.1 p -97.53 154.66 37.88 Favored Pre-proline 0 C--N 1.326 -0.441 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.002 179.721 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_exo -59.54 -17.92 44.16 Favored 'Trans proline' 0 C--N 1.343 0.281 0 C-N-CA 122.466 2.111 . . . . 0.0 112.029 179.339 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.14 -43.48 17.72 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.883 0.373 . . . . 0.0 110.573 179.629 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.576 ' O ' HG23 ' A' ' 19' ' ' VAL . 27.8 mt -72.6 -27.5 25.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.577 179.086 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 17.4 ttm180 -75.6 -44.77 41.32 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.367 178.732 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -67.84 -39.18 83.87 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.698 179.031 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.523 ' HA ' ' OD2' ' A' ' 21' ' ' ASP . 78.2 t60 -60.34 -57.23 13.67 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.843 -0.428 . . . . 0.0 109.843 178.989 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.625 HG22 HG21 ' A' ' 73' ' ' ILE . 35.7 t -61.52 -47.68 92.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 120.778 0.323 . . . . 0.0 110.146 178.477 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.713 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . . . -57.98 -42.34 84.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.958 179.755 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.523 ' OD2' ' HA ' ' A' ' 18' ' ' HIS . 0.9 OUTLIER -59.54 -35.21 73.77 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.118 0.485 . . . . 0.0 110.053 179.96 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.639 ' O ' HD12 ' A' ' 26' ' ' LEU . 25.5 mmm180 -76.24 -26.64 56.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.541 179.415 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.713 ' HG ' ' HA ' ' A' ' 20' ' ' ALA . 4.1 mt -68.09 -56.48 8.69 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.01 0.434 . . . . 0.0 110.298 179.484 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.65 -23.58 64.89 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.366 179.736 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 1.2 tmtm? -78.31 -30.98 48.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.107 0.479 . . . . 0.0 110.344 179.459 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.776 HD11 HG21 ' A' ' 77' ' ' ILE . 4.8 mt -80.26 56.0 2.37 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.649 179.556 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -55.4 -44.42 76.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.402 -179.634 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.454 ' HG2' ' NE1' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -94.01 20.0 8.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.547 -179.717 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.613 ' HB3' HD13 ' A' ' 84' ' ' LEU . 9.4 m95 -146.94 20.13 1.26 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.679 0.276 . . . . 0.0 110.947 -179.67 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.427 ' O ' ' N ' ' A' ' 32' ' ' HIS . 3.2 tp60 -125.29 -43.92 1.9 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.946 0.403 . . . . 0.0 110.19 179.467 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER 40.4 -89.06 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 115.535 -0.757 . . . . 0.0 112.027 179.646 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . 0.427 ' N ' ' O ' ' A' ' 30' ' ' GLN . 57.8 m-70 -127.14 -51.14 1.42 Allowed 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 111.873 0.323 . . . . 0.0 111.873 -179.468 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.867 HD22 HG21 ' A' ' 53' ' ' ILE . 21.2 mt 73.75 5.76 4.88 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 120.875 0.369 . . . . 0.0 111.123 -179.202 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.83 HG21 ' HB3' ' A' ' 54' ' ' ASN . 6.1 tt 34.15 34.05 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.261 0 N-CA-C 113.196 0.813 . . . . 0.0 113.196 179.428 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.454 ' CB ' ' O ' ' A' ' 34' ' ' ILE . 4.4 m120 77.45 77.37 0.15 Allowed Pre-proline 0 C--N 1.321 -0.65 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 -176.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.567 ' HB3' HG23 ' A' ' 53' ' ' ILE . 90.7 Cg_endo -80.72 173.16 12.45 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 123.244 2.63 . . . . 0.0 113.394 -178.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . 0.532 ' C ' HD12 ' A' ' 38' ' ' ILE . 0.2 OUTLIER -140.45 126.83 19.98 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.109 179.854 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.678 ' N ' HD12 ' A' ' 38' ' ' ILE . 3.0 mp -118.88 136.54 55.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.393 179.587 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 4.9 mt -121.06 148.64 24.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.566 -179.336 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.609 HD12 ' HB3' ' A' ' 6' ' ' SER . 1.3 mt -124.24 126.8 46.71 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.624 -0.717 . . . . 0.0 110.643 179.583 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 2.8 m -123.93 -174.26 2.94 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.507 179.898 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.412 ' HG3' ' CD2' ' A' ' 47' ' ' PHE . 11.0 tttm -160.95 140.71 10.79 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.424 0.631 . . . . 0.0 111.396 -179.845 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 65.2 mt-10 -131.41 162.15 57.74 Favored Pre-proline 0 C--N 1.322 -0.596 0 CA-C-N 115.026 -0.988 . . . . 0.0 109.305 179.347 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_endo -56.43 -25.7 59.12 Favored 'Trans proline' 0 N--CA 1.464 -0.229 0 C-N-CA 121.967 1.778 . . . . 0.0 111.95 179.621 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.09 -7.81 56.41 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.121 -0.945 . . . . 0.0 112.796 -179.059 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 150.52 -163.81 29.67 Favored Glycine 0 C--O 1.224 -0.522 0 C-N-CA 120.229 -0.986 . . . . 0.0 112.245 179.869 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.412 ' CD2' ' HG3' ' A' ' 42' ' ' LYS . 18.0 m-85 -108.87 154.85 21.54 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.499 0.666 . . . . 0.0 111.796 179.953 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.581 HG22 ' HG2' ' A' ' 65' ' ' LYS . 53.1 t -128.69 139.39 52.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 114.927 -1.033 . . . . 0.0 111.145 -179.27 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -130.42 123.91 30.89 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.525 179.441 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 28.7 m-20 -118.67 146.25 44.84 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.65 -0.25 . . . . 0.0 110.727 -179.845 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.609 ' CB ' HD11 ' A' ' 76' ' ' LEU . . . -145.66 140.64 27.45 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.724 -0.39 . . . . 0.0 111.484 179.8 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.407 HG23 HG22 ' A' ' 61' ' ' VAL . 3.0 m -134.59 128.96 34.23 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 179.102 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.867 HG21 HD22 ' A' ' 33' ' ' LEU . 21.4 mt -133.75 139.34 48.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 C-N-CA 120.724 -0.391 . . . . 0.0 111.852 -179.277 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.83 ' HB3' HG21 ' A' ' 34' ' ' ILE . 0.9 OUTLIER -99.86 145.38 27.83 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.85 179.116 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.416 ' HB ' ' HD2' ' A' ' 56' ' ' PRO . 18.9 p -138.76 158.85 69.35 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.502 179.261 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.416 ' HD2' ' HB ' ' A' ' 55' ' ' THR . 60.6 Cg_endo -73.96 -1.41 10.82 Favored 'Trans proline' 0 N--CA 1.463 -0.31 0 C-N-CA 121.772 1.648 . . . . 0.0 112.729 -179.243 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -126.5 2.39 6.91 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.567 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 162.31 -164.8 35.74 Favored Glycine 0 C--N 1.333 0.363 0 C-N-CA 120.405 -0.902 . . . . 0.0 112.925 -179.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 21.3 t -132.8 148.16 31.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.802 0.334 . . . . 0.0 111.083 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.417 HD11 HD21 ' A' ' 84' ' ' LEU . 14.1 mt -121.09 136.01 55.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.428 -179.672 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.407 HG22 HG23 ' A' ' 52' ' ' THR . 21.3 t -140.69 137.29 35.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.657 179.657 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.57 ' O ' HD12 ' A' ' 76' ' ' LEU . . . -153.09 155.86 37.6 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.279 0.561 . . . . 0.0 111.892 -179.418 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 88.8 p -143.98 157.41 44.35 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.252 -0.885 . . . . 0.0 111.682 -179.31 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.797 ' O ' ' HB1' ' A' ' 72' ' ' ALA . . . -150.92 99.64 0.2 Allowed Glycine 0 C--N 1.332 0.323 0 CA-C-N 115.833 -0.622 . . . . 0.0 111.559 179.461 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.581 ' HG2' HG22 ' A' ' 48' ' ' VAL . 59.9 mttt -100.83 44.57 1.01 Allowed 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -178.966 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 12.4 t-80 -75.66 155.31 35.89 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.256 178.709 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -60.46 -26.81 67.06 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.685 0.278 . . . . 0.0 111.29 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -97.09 116.7 29.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.99 0.424 . . . . 0.0 111.329 -179.449 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 1.7 tmt? -47.57 -46.42 28.01 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.665 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 -66.48 -41.41 89.01 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.31 -179.534 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 35.4 m -65.41 -37.67 87.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.787 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.797 ' HB1' ' O ' ' A' ' 64' ' ' GLY . . . -61.88 -51.54 67.77 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.822 179.782 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.625 HG21 HG22 ' A' ' 19' ' ' VAL . 7.7 mt -61.64 -42.5 94.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 120.84 0.352 . . . . 0.0 110.319 179.561 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -63.67 -40.2 96.24 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.109 179.253 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -66.47 -42.58 87.32 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.635 179.413 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.609 HD11 ' CB ' ' A' ' 51' ' ' ALA . 0.2 OUTLIER -52.55 -60.94 2.63 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 179.3 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.776 HG21 HD11 ' A' ' 26' ' ' LEU . 21.9 mt -56.66 -30.29 31.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 178.706 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -59.19 -29.06 67.2 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-O 121.272 0.558 . . . . 0.0 109.974 178.069 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.46 ' HB2' ' HB1' ' A' ' 62' ' ' ALA . 1.2 mptt -86.49 -29.32 22.84 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.384 179.184 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.695 ' O ' HD12 ' A' ' 84' ' ' LEU . 84.1 mt -63.14 -49.76 73.09 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 177.671 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.46 ' HG3' ' CG ' ' A' ' 29' ' ' TRP . 4.1 tt0 -60.04 -46.44 89.51 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 114.926 -1.033 . . . . 0.0 110.416 177.759 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.51 -33.86 75.74 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.317 -179.506 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.427 HE22 ' HB2' ' A' ' 62' ' ' ALA . 37.0 mt-30 -74.73 -42.36 58.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.836 0.351 . . . . 0.0 110.451 179.765 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.695 HD12 ' O ' ' A' ' 80' ' ' LEU . 1.5 mt -65.05 -29.26 70.14 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.61 179.523 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.435 ' O ' ' HG3' ' A' ' 88' ' ' GLN . 2.4 t-20 -61.81 -49.26 77.05 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.133 0.492 . . . . 0.0 110.256 179.936 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.465 ' HA ' ' CD2' ' A' ' 89' ' ' HIS . 0.1 OUTLIER -76.69 -20.65 56.36 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.974 179.519 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.568 HD23 ' C ' ' A' ' 87' ' ' LEU . 9.2 tt -71.31 -36.07 71.49 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -179.002 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.435 ' HG3' ' O ' ' A' ' 85' ' ' ASN . 0.4 OUTLIER -76.43 -99.26 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 111.74 0.274 . . . . 0.0 111.74 -178.797 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.465 ' CD2' ' HA ' ' A' ' 86' ' ' LYS . 70.5 m-70 50.95 -91.34 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.788 0.328 . . . . 0.0 110.89 -179.381 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 68.66 -71.57 0.11 Allowed 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.06 179.661 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 140.79 -28.18 2.42 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.316 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -155.47 52.33 0.59 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.829 0.347 . . . . 0.0 110.772 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -80.78 65.3 5.87 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.158 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.31 27.22 0.3 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.909 179.846 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 177.29 90.81 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.66 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -122.9 -66.86 0.99 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.195 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . 60.06 163.21 0.05 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.016 -179.926 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -103.5 -58.66 1.84 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.897 179.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -158.48 113.44 2.58 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.779 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.573 ' O ' HG23 ' A' ' 100' ' ' VAL . 27.7 m -66.86 108.51 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.152 -179.968 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 30.2 mttt -121.26 173.28 7.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.898 179.938 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -113.91 178.92 4.11 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.973 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.519 ' HB1' ' CG2' ' A' ' 106' ' ' VAL . . . -161.62 141.38 10.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.144 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 49.8 m-80 -146.01 142.13 28.34 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.831 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 60.42 31.2 20.29 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.827 179.975 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' VAL . . . . . 0.56 ' O ' HG23 ' A' ' 106' ' ' VAL . 17.1 m -136.97 98.6 1.67 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.14 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -76.38 154.77 34.63 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.859 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 19.6 pt-20 -68.18 125.93 27.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.894 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 12.3 p -109.55 145.1 16.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.117 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -84.6 100.26 11.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.852 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 62.31 149.96 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.912 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.243 -0.884 . . . . 0.0 110.914 179.965 . . . . . . . . 0 0 . 1 stop_ save_