data_5lo3_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 5lo3 _Structure_validation_residue.Date_analyzed 2017-05-12 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 full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.323 . . . . . . . . 1.66 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 16.1 Cg_exo -66.1 162.27 36.35 Favored 'Trans proline' 0 N--CA 1.463 -0.304 0 C-N-CA 122.736 2.291 . . . . 1.19 111.739 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.424 ' HG2' ' CD2' ' A' ' 27' ' ' 0A1 . 59.5 Cg_endo -79.37 179.8 6.07 Favored 'Trans proline' 0 N--CA 1.457 -0.659 0 C-N-CA 122.464 2.109 . . . . 0.86 112.118 179.759 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 2.2 p -62.9 102.44 0.35 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.908 -0.587 . . . . 1.31 110.95 177.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 25.1 pttm -90.44 125.07 61.03 Favored Pre-proline 0 N--CA 1.449 -0.516 0 CA-C-O 120.899 0.381 . . . . 2.55 110.727 179.516 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -77.97 157.45 30.78 Favored 'Trans proline' 0 N--CA 1.458 -0.566 0 C-N-CA 122.634 2.223 . . . . 0.69 112.284 -178.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 9.3 t -72.55 145.99 47.05 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.023 -0.535 . . . . 1.3 110.285 177.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.431 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 34.4 mmtp -79.16 129.66 71.93 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-N 116.058 -0.519 . . . . 2.29 110.603 -177.083 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' A' ' 7' ' ' LYS . 2.4 Cg_endo -78.12 98.23 1.19 Allowed 'Trans proline' 0 N--CA 1.458 -0.615 0 C-N-CA 122.358 2.039 . . . . 1.08 112.109 178.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -100.96 -70.77 0.91 Allowed Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.887 -0.673 . . . . 0.51 111.443 175.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -84.74 -27.13 27.15 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.563 0.697 . . . . 2.41 110.19 178.102 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . 0.4 ' C ' ' H ' ' A' ' 13' ' ' THR . 16.6 m120 -96.53 21.28 9.45 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.086 -0.961 . . . . 3.19 110.138 -178.433 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -76.39 32.15 0.13 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.689 -0.687 . . . . 1.05 112.672 -175.043 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.4 ' H ' ' C ' ' A' ' 11' ' ' ASN . 40.6 p -62.5 151.04 84.29 Favored Pre-proline 0 C--N 1.319 -0.741 0 CA-C-N 116.237 -0.438 . . . . 1.36 109.893 175.338 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -52.27 -30.17 41.19 Favored 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.501 2.134 . . . . 0.9 112.087 179.391 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -67.5 -58.25 5.07 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.408 -0.814 . . . . 2.44 111.178 179.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 61.2 tttm -74.51 -29.91 61.59 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.103 0.477 . . . . 2.33 110.477 -175.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.451 ' O ' ' HG2' ' A' ' 21' ' ' GLN . 56.7 tp -61.52 -38.72 88.4 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.87 -0.604 . . . . 1.12 110.252 176.184 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.67 -37.49 82.43 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.238 -0.437 . . . . 1.1 110.392 177.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 45.3 tttp -61.01 -44.73 96.98 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.359 0.599 . . . . 3.08 109.678 175.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' 0A1 . . . . . 0.562 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.451 ' HG2' ' O ' ' A' ' 17' ' ' LEU . 86.6 mm-40 -62.63 -41.67 99.15 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.193 -0.458 . . . . 2.56 111.271 179.415 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.3 -30.86 70.83 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.924 -0.58 . . . . 1.13 110.922 179.684 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -79.07 -30.36 43.92 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.169 -0.468 . . . . 0.57 110.049 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.562 ' HG ' ' O ' ' A' ' 20' ' ' 0A1 . 65.4 mt -61.42 -27.18 68.36 Favored 'General case' 0 CA--C 1.521 -0.173 0 CA-C-N 115.898 -0.592 . . . . 1.15 110.563 175.852 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.05 -30.65 70.45 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.257 0.551 . . . . 1.09 110.627 177.594 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -90.96 -45.9 8.47 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.409 -0.814 . . . . 2.99 110.66 178.059 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' 0A1 . . . . . 0.424 ' CD2' ' HG2' ' A' ' 2' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -63.57 -23.28 67.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.451 -0.34 . . . . 0.72 111.427 -172.725 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 47.4 tttm -64.39 -57.7 8.56 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 116.16 -0.473 . . . . 2.94 110.624 176.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -68.62 -34.73 76.26 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.126 0.489 . . . . 0.94 110.454 178.055 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -62.78 -39.19 93.44 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.591 -0.731 . . . . 2.0 110.422 -178.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.3 -36.12 83.07 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 120.943 0.401 . . . . 1.56 110.99 178.133 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -70.38 -43.52 69.92 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.14 -0.482 . . . . 1.46 109.881 177.129 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.458 0 CA-C-N 116.572 -0.285 . . . . 1.45 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.2 . . . . . . . . 1.66 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -71.4 145.48 48.08 Favored 'Trans proline' 0 N--CA 1.452 -0.949 0 C-N-CA 122.282 1.988 . . . . 1.19 111.979 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.471 ' HG2' ' CD2' ' A' ' 27' ' ' 0A1 . 41.9 Cg_endo -71.28 -179.41 3.56 Favored 'Trans proline' 0 C--O 1.235 0.335 0 C-N-CA 122.594 2.196 . . . . 0.86 112.161 178.731 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 19.7 p -63.42 99.07 0.18 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.019 -0.537 . . . . 1.31 111.048 178.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.89 129.45 64.7 Favored Pre-proline 0 C--N 1.323 -0.558 0 CA-C-N 116.282 -0.417 . . . . 2.55 110.677 179.069 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -78.88 141.66 17.05 Favored 'Trans proline' 0 N--CA 1.458 -0.587 0 C-N-CA 122.298 1.998 . . . . 0.69 111.827 177.014 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 6.1 t -65.2 141.4 58.67 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.787 -0.449 . . . . 1.3 109.787 176.567 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 27.3 mmtp -80.54 129.59 68.15 Favored Pre-proline 0 C--N 1.321 -0.655 0 CA-C-N 116.277 -0.419 . . . . 2.29 110.487 -173.089 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_exo -69.69 110.2 2.48 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.766 2.311 . . . . 1.08 112.699 -176.683 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -100.96 -69.36 0.86 Allowed Glycine 0 N--CA 1.448 -0.551 0 C-N-CA 120.911 -0.661 . . . . 0.51 111.56 175.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -90.51 -28.87 18.26 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.418 0.628 . . . . 2.41 110.584 179.358 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . 0.412 ' C ' ' H ' ' A' ' 13' ' ' THR . 30.5 p-10 -92.6 20.94 5.83 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.28 -0.873 . . . . 3.19 109.974 -178.316 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -77.74 31.56 0.16 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.221 -0.899 . . . . 1.05 112.379 -175.026 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.412 ' H ' ' C ' ' A' ' 11' ' ' ASN . 12.0 p -64.03 151.83 88.97 Favored Pre-proline 0 C--N 1.318 -0.795 0 CA-C-N 116.129 -0.487 . . . . 1.36 109.974 173.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -57.07 -31.19 89.51 Favored 'Trans proline' 0 C--O 1.233 0.26 0 C-N-CA 122.559 2.173 . . . . 0.9 111.785 -177.516 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -63.06 -49.37 74.81 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 115.827 -0.624 . . . . 2.44 110.796 178.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.491 ' O ' ' HD3' ' A' ' 16' ' ' LYS . 9.4 tmtt? -81.42 -33.47 32.16 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.983 -0.553 . . . . 2.33 109.747 -177.005 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.411 ' O ' ' HG3' ' A' ' 21' ' ' GLN . 46.4 tp -61.59 -41.69 97.78 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.824 -0.626 . . . . 1.12 111.203 -179.342 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.84 -38.28 88.45 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.789 0.328 . . . . 1.1 110.537 177.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -63.39 -41.48 98.76 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.837 -0.619 . . . . 3.08 109.917 176.303 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.411 ' HG3' ' O ' ' A' ' 17' ' ' LEU . 51.1 mt-30 -63.22 -42.37 99.27 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.238 -0.437 . . . . 2.56 111.028 177.364 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.75 -39.38 93.96 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.78 -0.645 . . . . 1.13 110.804 178.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -70.33 -32.93 70.87 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.024 -0.535 . . . . 0.57 110.367 178.487 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 42.3 mt -61.89 -32.85 73.26 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 116.341 -0.391 . . . . 1.15 110.867 176.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.93 -25.17 68.2 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.181 0.515 . . . . 1.09 110.617 178.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 44.2 mmtm -90.23 -44.38 9.77 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.582 -0.735 . . . . 2.99 109.938 177.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' 0A1 . . . . . 0.471 ' CD2' ' HG2' ' A' ' 2' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 97.2 mt-30 -63.93 -27.66 69.3 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.404 -0.362 . . . . 0.72 111.134 -176.098 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 58.6 tttm -64.01 -54.64 31.17 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 120.934 0.397 . . . . 2.94 110.619 178.153 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -67.43 -34.86 78.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.096 0.474 . . . . 0.94 110.052 178.634 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 21.1 tp -63.2 -34.65 78.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.771 -0.649 . . . . 2.0 110.261 177.413 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.37 -32.2 73.56 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.879 -0.601 . . . . 1.56 110.664 176.343 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -77.18 -29.42 54.41 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.209 0.528 . . . . 1.46 109.876 177.184 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.607 0 CA-C-N 116.244 -0.435 . . . . 1.45 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.079 . . . . . . . . 1.66 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -61.93 167.85 9.82 Favored 'Trans proline' 0 C--O 1.235 0.362 0 C-N-CA 122.931 2.421 . . . . 1.19 112.452 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.454 ' HB3' ' OD1' ' A' ' 30' ' ' ASP . 23.2 Cg_endo -64.11 -178.28 0.59 Allowed 'Trans proline' 0 C--O 1.234 0.275 0 C-N-CA 122.614 2.209 . . . . 0.86 111.907 174.598 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 22.6 p -61.31 99.98 0.12 Allowed 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.991 -0.549 . . . . 1.31 110.814 178.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.479 ' HA ' ' HD3' ' A' ' 5' ' ' PRO . 0.2 OUTLIER -82.92 140.74 43.37 Favored Pre-proline 0 N--CA 1.449 -0.521 0 C-N-CA 120.857 -0.337 . . . . 2.55 110.645 -178.815 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.479 ' HD3' ' HA ' ' A' ' 4' ' ' LYS . 7.6 Cg_endo -86.62 154.85 8.99 Favored 'Trans proline' 0 N--CA 1.453 -0.897 0 C-N-CA 122.832 2.355 . . . . 0.69 112.326 -176.304 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 13.5 t -70.06 147.54 49.89 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.068 -0.514 . . . . 1.3 110.288 178.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 42.4 mmtm -88.21 130.94 44.17 Favored Pre-proline 0 C--N 1.322 -0.608 0 CA-C-N 116.392 -0.367 . . . . 2.29 110.632 -174.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.479 ' HA ' ' ND2' ' A' ' 11' ' ' ASN . 43.6 Cg_endo -69.76 97.02 0.61 Allowed 'Trans proline' 0 C--O 1.233 0.233 0 C-N-CA 122.627 2.218 . . . . 1.08 113.076 -178.41 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -100.44 -72.3 0.99 Allowed Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.362 -0.923 . . . . 0.51 111.275 174.268 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -100.0 2.47 43.5 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.583 0.706 . . . . 2.41 109.69 175.586 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . 0.479 ' ND2' ' HA ' ' A' ' 8' ' ' PRO . 5.7 p-10 -113.43 21.54 15.07 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 114.878 -1.055 . . . . 3.19 109.691 -179.101 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -77.2 14.01 1.01 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.232 -0.894 . . . . 1.05 111.887 -175.528 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 1.1 p -60.42 141.49 91.42 Favored Pre-proline 0 N--CA 1.449 -0.504 0 CA-C-N 115.949 -0.569 . . . . 1.36 110.561 172.296 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_exo -50.7 -32.4 36.07 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 123.054 2.503 . . . . 0.9 113.103 -174.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 21.5 mm-40 -62.2 -47.7 83.29 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.531 -0.304 . . . . 2.44 111.334 -177.605 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.446 ' HD3' ' HB2' ' A' ' 11' ' ' ASN . 77.3 tttt -90.36 -28.59 18.6 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.086 0.47 . . . . 2.33 110.279 -178.945 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.497 ' O ' ' HG2' ' A' ' 21' ' ' GLN . 62.7 tp -62.25 -45.88 91.32 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.792 -0.64 . . . . 1.12 110.878 178.456 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.55 -29.45 67.04 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.946 0.403 . . . . 1.1 110.649 177.656 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt -68.99 -36.71 78.15 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.345 -0.613 . . . . 3.08 109.345 175.25 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' 0A1 . . . . . 0.467 ' HD2' ' HB2' ' A' ' 5' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.497 ' HG2' ' O ' ' A' ' 17' ' ' LEU . 78.1 mm-40 -62.22 -41.17 98.14 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.108 0.48 . . . . 2.56 110.664 178.664 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.52 -30.85 66.4 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.75 -0.659 . . . . 1.13 111.113 178.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -74.34 -31.6 62.49 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.601 -0.518 . . . . 0.57 109.601 177.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 62.9 mt -62.89 -31.42 72.47 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.104 -0.498 . . . . 1.15 110.493 174.047 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.19 -22.76 66.94 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.151 0.501 . . . . 1.09 110.615 177.073 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.437 ' O ' ' HB3' ' A' ' 29' ' ' LYS . 58.4 mttp -90.63 -43.98 9.82 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.458 -0.792 . . . . 2.99 109.814 175.165 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -64.2 -23.29 67.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.843 0.354 . . . . 0.72 111.015 -177.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.437 ' HB3' ' O ' ' A' ' 26' ' ' LYS . 83.0 tttt -63.55 -61.02 2.6 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.9 -0.591 . . . . 2.94 110.511 175.845 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.454 ' OD1' ' HB3' ' A' ' 2' ' ' PRO . 16.2 t70 -66.81 -32.11 73.18 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.208 0.528 . . . . 0.94 110.205 179.261 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 18.3 tp -60.8 -31.42 70.82 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.541 -0.754 . . . . 2.0 110.759 179.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -62.96 -28.93 70.42 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.865 -0.607 . . . . 1.56 111.47 178.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -86.47 -26.13 24.81 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.373 0.606 . . . . 1.46 109.835 177.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.525 0 CA-C-N 116.315 -0.402 . . . . 1.45 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.207 . . . . . . . . 1.66 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_exo -63.62 154.51 68.6 Favored 'Trans proline' 0 C--O 1.235 0.326 0 C-N-CA 122.715 2.277 . . . . 1.19 111.793 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.435 ' HG3' ' OD1' ' A' ' 30' ' ' ASP . 5.8 Cg_exo -74.26 176.04 10.15 Favored 'Trans proline' 0 N--CA 1.46 -0.479 0 C-N-CA 122.592 2.195 . . . . 0.86 111.618 179.818 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 19.7 p -65.83 98.88 0.43 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.18 -0.464 . . . . 1.31 110.709 177.139 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.553 ' HB3' ' CE2' ' A' ' 27' ' ' 0A1 . 13.6 ptmt -88.05 127.31 58.0 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-N 116.095 -0.502 . . . . 2.55 111.294 -177.825 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -84.19 136.11 6.64 Favored 'Trans proline' 0 N--CA 1.452 -0.944 0 C-N-CA 122.463 2.109 . . . . 0.69 111.158 176.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 14.2 t -68.0 157.69 34.53 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.366 -0.379 . . . . 1.3 110.21 -178.631 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -78.46 128.1 78.73 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-N 116.344 -0.389 . . . . 2.29 110.729 -175.41 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 6.5 Cg_exo -73.45 121.51 7.2 Favored 'Trans proline' 0 N--CA 1.463 -0.268 0 C-N-CA 122.647 2.231 . . . . 1.08 111.788 176.529 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -100.27 -72.12 0.99 Allowed Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.486 -0.864 . . . . 0.51 112.013 179.291 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -99.29 -14.65 19.14 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 121.713 0.768 . . . . 2.41 109.751 177.083 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 19.3 p-10 -93.65 20.28 7.64 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 114.933 -1.031 . . . . 3.19 109.369 177.381 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -85.55 22.99 1.44 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.124 -0.944 . . . . 1.05 111.564 -175.239 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 35.6 p -55.26 146.86 39.28 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 116.058 -0.519 . . . . 1.36 110.385 177.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -48.29 -31.49 17.4 Favored 'Trans proline' 0 C--N 1.343 0.288 0 C-N-CA 122.723 2.282 . . . . 0.9 112.222 178.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -64.65 -54.1 37.16 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.851 -0.613 . . . . 2.44 111.48 177.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 15.2 tptm -81.94 -30.8 31.61 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.189 -0.459 . . . . 2.33 110.546 -174.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.452 ' O ' ' HG3' ' A' ' 21' ' ' GLN . 40.9 tp -62.52 -35.52 79.67 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.936 -0.575 . . . . 1.12 110.519 177.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.35 -31.94 73.32 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.328 -0.397 . . . . 1.1 110.669 177.456 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -72.63 -38.37 67.74 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.646 -0.501 . . . . 3.08 109.646 176.114 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' 0A1 . . . . . 0.493 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.452 ' HG3' ' O ' ' A' ' 17' ' ' LEU . 78.5 mt-30 -61.48 -49.5 76.51 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.961 -0.563 . . . . 2.56 110.741 177.281 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.33 -31.8 73.05 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.616 -0.72 . . . . 1.13 111.461 -179.288 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -76.71 -29.75 56.37 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.174 0.512 . . . . 0.57 109.797 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.493 ' HG ' ' O ' ' A' ' 20' ' ' 0A1 . 61.3 mt -63.38 -27.96 69.67 Favored 'General case' 0 C--O 1.225 -0.233 0 CA-C-N 115.803 -0.635 . . . . 1.15 110.777 174.408 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.55 -30.15 71.1 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.234 0.54 . . . . 1.09 110.483 178.375 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 72.6 mttt -78.96 -54.53 5.94 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.825 0.822 . . . . 2.99 109.175 175.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' 0A1 . . . . . 0.553 ' CE2' ' HB3' ' A' ' 4' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -62.27 -30.54 71.19 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.512 -0.313 . . . . 0.72 111.794 -170.299 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -61.05 -57.97 10.35 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-O 120.756 0.313 . . . . 2.94 110.459 179.33 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.435 ' OD1' ' HG3' ' A' ' 2' ' ' PRO . 38.2 t70 -69.48 -33.18 72.49 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.522 -0.308 . . . . 0.94 110.661 178.429 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -62.9 -39.21 93.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.396 -0.365 . . . . 2.0 110.622 -178.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.4 -34.44 78.17 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.325 -0.398 . . . . 1.56 111.062 178.432 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -82.23 -27.34 32.56 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.319 0.58 . . . . 1.46 110.199 178.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.376 0 CA-C-N 116.591 -0.277 . . . . 1.45 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.178 . . . . . . . . 1.66 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . 0.401 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . 21.2 Cg_exo -64.53 156.69 59.27 Favored 'Trans proline' 0 C--O 1.235 0.342 0 C-N-CA 122.692 2.261 . . . . 1.19 111.971 . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' A' ' 1' ' ' PRO . 14.8 Cg_exo -68.54 -177.64 1.57 Allowed 'Trans proline' 0 C--O 1.235 0.369 0 C-N-CA 122.85 2.367 . . . . 0.86 112.171 177.805 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 21.8 p -69.16 94.9 0.71 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.927 -0.579 . . . . 1.31 110.275 176.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 55.8 pttt -79.56 137.51 55.17 Favored Pre-proline 0 C--N 1.322 -0.594 0 CA-C-N 116.138 -0.483 . . . . 2.55 110.921 -178.079 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -73.42 151.5 48.01 Favored 'Trans proline' 0 N--CA 1.458 -0.614 0 C-N-CA 122.185 1.923 . . . . 0.69 112.015 178.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 4.4 t -67.97 135.09 51.82 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.021 -0.536 . . . . 1.3 110.752 178.417 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -73.07 128.73 87.37 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.826 -0.625 . . . . 2.29 110.18 179.618 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -76.71 83.18 2.13 Favored 'Trans proline' 0 N--CA 1.458 -0.56 0 C-N-CA 122.415 2.077 . . . . 1.08 112.669 -179.042 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -101.21 -71.25 0.92 Allowed Glycine 0 N--CA 1.447 -0.609 0 CA-C-N 115.537 -0.756 . . . . 0.51 111.586 175.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.4 m-20 -94.33 -9.86 34.57 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.548 0.69 . . . . 2.41 109.703 177.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . 0.448 ' C ' ' H ' ' A' ' 13' ' ' THR . 25.2 p-10 -112.86 22.34 14.57 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.845 -1.071 . . . . 3.19 110.239 -178.264 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.07 32.49 0.06 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.466 -0.788 . . . . 1.05 112.929 -175.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.448 ' H ' ' C ' ' A' ' 11' ' ' ASN . 65.3 p -62.8 149.27 89.98 Favored Pre-proline 0 C--N 1.317 -0.818 0 N-CA-C 110.109 -0.33 . . . . 1.36 110.109 175.76 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -51.76 -33.93 52.25 Favored 'Trans proline' 0 C--O 1.232 0.218 0 C-N-CA 122.423 2.082 . . . . 0.9 112.043 178.206 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -67.99 -53.64 24.53 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.633 -0.712 . . . . 2.44 111.238 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 17.1 tppt? -73.05 -32.7 65.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.908 -0.587 . . . . 2.33 110.311 -177.045 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.42 ' O ' ' HG3' ' A' ' 21' ' ' GLN . 62.3 tp -61.92 -42.32 98.96 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.687 -0.688 . . . . 1.12 110.803 177.608 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -70.35 -33.99 72.11 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.39 -0.368 . . . . 1.1 110.125 175.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 56.5 tptt -64.4 -40.79 96.49 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.005 -0.543 . . . . 3.08 110.08 175.656 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' 0A1 . . . . . 0.565 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.42 ' HG3' ' O ' ' A' ' 17' ' ' LEU . 78.5 mt-30 -62.27 -48.69 78.78 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.678 -0.692 . . . . 2.56 110.763 177.83 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.62 -33.82 76.51 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.746 -0.661 . . . . 1.13 111.311 -178.347 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -72.46 -30.29 64.43 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.184 -0.462 . . . . 0.57 110.074 -179.607 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.565 ' HG ' ' O ' ' A' ' 20' ' ' 0A1 . 71.3 mt -61.11 -31.62 71.31 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 116.231 -0.44 . . . . 1.15 110.581 175.758 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.08 -28.74 70.29 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.252 0.549 . . . . 1.09 110.709 178.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp -90.85 -44.65 9.27 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.465 -0.789 . . . . 2.99 110.448 177.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -63.48 -29.85 71.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.844 0.354 . . . . 0.72 111.266 -174.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 62.9 tttp -64.35 -51.98 60.64 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 115.956 -0.565 . . . . 2.94 110.35 177.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -67.5 -36.75 81.67 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.793 -0.639 . . . . 0.94 110.299 177.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 34.7 tp -61.36 -34.1 74.74 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.599 -0.728 . . . . 2.0 111.089 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.45 -29.54 70.59 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.02 0.438 . . . . 1.56 110.84 177.038 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -78.72 -28.85 45.09 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.008 -0.542 . . . . 1.46 110.078 179.452 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.452 0 CA-C-N 116.44 -0.345 . . . . 1.45 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.13 . . . . . . . . 1.66 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_exo -63.87 166.67 15.56 Favored 'Trans proline' 0 C--O 1.234 0.306 0 C-N-CA 122.78 2.32 . . . . 1.19 112.088 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.507 ' HB3' ' OD1' ' A' ' 30' ' ' ASP . 16.9 Cg_exo -67.63 174.52 7.35 Favored 'Trans proline' 0 C--O 1.233 0.245 0 C-N-CA 122.591 2.194 . . . . 0.86 111.744 175.755 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.1 p -69.24 94.07 0.67 Allowed 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.182 0.515 . . . . 1.31 110.881 177.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.441 ' HA ' ' HD3' ' A' ' 5' ' ' PRO . 11.3 ptmm? -79.42 132.84 61.11 Favored Pre-proline 0 C--N 1.326 -0.422 0 CA-C-N 115.77 -0.65 . . . . 2.55 110.95 -176.388 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' A' ' 4' ' ' LYS . 3.4 Cg_endo -85.31 167.27 10.6 Favored 'Trans proline' 0 N--CA 1.459 -0.511 0 C-N-CA 122.958 2.439 . . . . 0.69 111.821 -178.903 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 14.2 t -75.38 150.41 38.39 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 110.185 -0.302 . . . . 1.3 110.185 179.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.5 mptm? -86.22 136.76 35.39 Favored Pre-proline 0 C--N 1.322 -0.613 0 CA-C-N 116.246 -0.433 . . . . 2.29 110.846 -178.058 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.542 ' HA ' ' OD1' ' A' ' 11' ' ' ASN . 36.3 Cg_endo -77.36 93.2 1.09 Allowed 'Trans proline' 0 N--CA 1.453 -0.866 0 C-N-CA 122.498 2.132 . . . . 1.08 112.807 -179.546 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -97.43 -71.14 1.04 Allowed Glycine 0 N--CA 1.448 -0.5 0 C-N-CA 120.612 -0.804 . . . . 0.51 111.367 175.248 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -97.5 -7.77 30.73 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.502 0.668 . . . . 2.41 109.546 174.392 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . 0.542 ' OD1' ' HA ' ' A' ' 8' ' ' PRO . 9.8 p30 -102.56 20.73 16.57 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.313 -0.858 . . . . 3.19 109.496 175.58 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.402 ' HA ' ' HB2' ' A' ' 8' ' ' PRO . . . -77.74 20.15 0.35 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.48 -0.782 . . . . 1.05 111.306 -178.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.448 ' H ' ' C ' ' A' ' 11' ' ' ASN . 62.0 p -59.18 149.17 69.03 Favored Pre-proline 0 C--N 1.323 -0.558 0 CA-C-N 115.531 -0.759 . . . . 1.36 110.334 176.525 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_exo -51.09 -34.64 48.23 Favored 'Trans proline' 0 C--O 1.233 0.242 0 C-N-CA 122.344 2.029 . . . . 0.9 112.236 178.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 42.5 mm-40 -66.92 -52.72 39.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.993 -0.549 . . . . 2.44 111.431 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.499 ' O ' ' HD3' ' A' ' 16' ' ' LYS . 6.7 tmtm? -78.23 -33.39 49.88 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.179 -0.464 . . . . 2.33 109.902 -174.462 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.444 ' O ' ' HG2' ' A' ' 21' ' ' GLN . 49.2 tp -59.96 -44.94 94.12 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.067 -0.515 . . . . 1.12 110.549 179.708 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.51 -29.9 70.93 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.057 -0.52 . . . . 1.1 110.717 178.717 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 48.0 tptt -74.65 -40.1 61.65 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.047 -0.524 . . . . 3.08 109.828 178.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' 0A1 . . . . . 0.471 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.444 ' HG2' ' O ' ' A' ' 17' ' ' LEU . 80.5 mm-40 -61.25 -43.93 98.07 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.018 -0.537 . . . . 2.56 110.74 176.733 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.16 -37.76 86.43 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.703 -0.68 . . . . 1.13 111.144 178.69 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -75.65 -30.57 59.49 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.822 0.344 . . . . 0.57 110.336 179.376 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 20' ' ' 0A1 . 49.7 mt -62.66 -32.37 73.42 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 116.459 -0.337 . . . . 1.15 110.688 176.002 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.46 -23.36 67.37 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.33 0.586 . . . . 1.09 110.377 176.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 88.9 mttt -90.36 -48.54 7.06 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.425 -0.807 . . . . 2.99 109.696 176.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -64.63 -32.79 74.61 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.735 0.303 . . . . 0.72 110.904 -175.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 59.5 tttm -65.13 -50.43 66.07 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 116.104 -0.498 . . . . 2.94 110.212 175.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.507 ' OD1' ' HB3' ' A' ' 2' ' ' PRO . 30.4 t70 -65.76 -30.52 71.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.794 -0.639 . . . . 0.94 110.282 177.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 18.3 tp -62.69 -40.46 97.17 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.775 -0.648 . . . . 2.0 110.574 176.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.76 -35.41 80.63 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.096 -0.502 . . . . 1.56 111.111 178.006 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -72.98 -39.99 65.66 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.003 0.43 . . . . 1.46 110.234 177.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.553 0 CA-C-N 116.546 -0.297 . . . . 1.45 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.228 -0.055 . . . . . . . . 1.66 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -63.49 159.26 41.24 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.752 2.301 . . . . 1.19 113.172 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.427 ' HG2' ' CD2' ' A' ' 27' ' ' 0A1 . 34.7 Cg_endo -68.94 175.29 7.6 Favored 'Trans proline' 0 N--CA 1.464 -0.235 0 C-N-CA 122.742 2.295 . . . . 0.86 111.62 175.728 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 6.2 p -61.41 107.52 0.79 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.435 -0.348 . . . . 1.31 111.326 179.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -89.4 122.4 68.47 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 116.121 -0.49 . . . . 2.55 110.666 -178.714 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.406 ' HB2' ' HD2' ' A' ' 20' ' ' 0A1 . 57.1 Cg_endo -74.25 147.61 37.71 Favored 'Trans proline' 0 N--CA 1.459 -0.514 0 C-N-CA 122.359 2.04 . . . . 0.69 112.313 -178.642 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 9.3 t -73.74 148.22 42.81 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.853 -0.612 . . . . 1.3 110.616 -179.464 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp -73.66 130.19 84.07 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 116.447 -0.342 . . . . 2.29 110.516 -179.277 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -72.87 96.46 0.85 Allowed 'Trans proline' 0 N--CA 1.462 -0.338 0 C-N-CA 122.577 2.185 . . . . 1.08 112.28 -179.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -100.65 -70.91 0.93 Allowed Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.794 -0.717 . . . . 0.51 112.65 179.714 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -93.77 -24.12 17.92 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.601 0.715 . . . . 2.41 110.249 -178.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . 0.427 ' C ' ' H ' ' A' ' 13' ' ' THR . 16.2 m120 -99.26 21.35 12.05 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.218 -0.901 . . . . 3.19 109.765 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.38 23.99 0.05 Allowed 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 113.174 0.805 . . . . 1.05 113.174 -172.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.427 ' H ' ' C ' ' A' ' 11' ' ' ASN . 16.2 p -53.13 149.34 13.0 Favored Pre-proline 0 C--N 1.322 -0.609 0 O-C-N 123.151 0.282 . . . . 1.36 110.772 174.331 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -55.53 -32.21 81.78 Favored 'Trans proline' 0 N--CA 1.464 -0.231 0 C-N-CA 122.813 2.342 . . . . 0.9 111.93 -176.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -63.95 -52.07 61.46 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.755 -0.657 . . . . 2.44 110.566 178.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 56.3 tttm -75.63 -31.55 59.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.034 -0.53 . . . . 2.33 110.199 -177.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.533 ' O ' ' HG2' ' A' ' 21' ' ' GLN . 62.1 tp -62.82 -48.93 76.95 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.73 -0.668 . . . . 1.12 110.961 -179.793 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.53 -32.84 73.9 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.931 0.396 . . . . 1.1 110.51 177.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt -67.47 -36.52 81.29 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.632 -0.507 . . . . 3.08 109.632 177.034 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' 0A1 . . . . . 0.467 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.533 ' HG2' ' O ' ' A' ' 17' ' ' LEU . 82.4 mm-40 -63.41 -41.96 98.73 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.978 -0.555 . . . . 2.56 110.842 178.613 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.23 -34.23 77.03 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.111 -0.495 . . . . 1.13 110.797 178.032 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -70.18 -33.36 71.64 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.964 -0.562 . . . . 0.57 110.185 178.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' A' ' 20' ' ' 0A1 . 58.0 mt -61.9 -32.8 73.22 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.951 -0.568 . . . . 1.15 110.752 176.738 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.71 -25.64 68.29 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.991 -0.55 . . . . 1.09 110.819 178.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -90.23 -47.46 7.77 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.651 -0.704 . . . . 2.99 110.259 177.494 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' 0A1 . . . . . 0.427 ' CD2' ' HG2' ' A' ' 2' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.454 ' HA ' ' HB3' ' A' ' 31' ' ' LEU . 76.9 mt-30 -64.42 -22.79 67.07 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.443 -0.344 . . . . 0.72 111.858 -176.785 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 60.9 tttm -63.74 -59.01 5.11 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 121.122 0.486 . . . . 2.94 110.233 176.444 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -68.79 -31.74 70.98 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.967 -0.56 . . . . 0.94 110.396 178.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.454 ' HB3' ' HA ' ' A' ' 28' ' ' GLN . 31.5 tp -62.1 -33.95 75.41 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.842 -0.617 . . . . 2.0 110.978 179.086 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.27 -30.45 71.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.206 -0.452 . . . . 1.56 110.831 177.214 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -84.71 -33.48 23.14 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.108 -0.497 . . . . 1.46 110.192 177.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.452 0 CA-C-N 116.521 -0.309 . . . . 1.45 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.147 . . . . . . . . 1.66 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -64.42 164.88 21.75 Favored 'Trans proline' 0 C--O 1.234 0.298 0 C-N-CA 122.592 2.195 . . . . 1.19 112.21 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.453 ' HG2' ' CD2' ' A' ' 27' ' ' 0A1 . 29.5 Cg_endo -67.07 178.89 2.63 Favored 'Trans proline' 0 N--CA 1.462 -0.339 0 C-N-CA 122.482 2.121 . . . . 0.86 111.752 174.271 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.7 p -74.16 113.32 11.22 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 116.152 -0.476 . . . . 1.31 111.311 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.402 ' HA ' ' HD3' ' A' ' 5' ' ' PRO . 14.7 ptmt -91.83 138.33 24.97 Favored Pre-proline 0 C--N 1.322 -0.593 0 CA-C-N 116.032 -0.531 . . . . 2.55 110.204 178.719 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 4' ' ' LYS . 55.9 Cg_endo -83.88 169.35 11.85 Favored 'Trans proline' 0 N--CA 1.456 -0.696 0 C-N-CA 122.446 2.097 . . . . 0.69 112.994 -175.822 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 11.8 t -78.51 148.49 33.43 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.799 -0.637 . . . . 1.3 110.64 -179.629 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp -79.94 129.24 71.19 Favored Pre-proline 0 C--N 1.323 -0.547 0 CA-C-N 116.151 -0.477 . . . . 2.29 110.761 -179.419 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -80.91 101.72 1.31 Allowed 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 122.573 2.182 . . . . 1.08 112.503 177.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -100.27 -70.69 0.93 Allowed Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.753 -0.737 . . . . 0.51 112.148 178.397 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -98.49 -26.7 14.35 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.475 0.655 . . . . 2.41 110.381 177.479 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -89.37 21.01 3.51 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.412 -0.813 . . . . 3.19 109.444 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -76.97 27.86 0.14 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.258 -0.883 . . . . 1.05 112.667 -173.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 19.2 p -58.17 154.23 31.81 Favored Pre-proline 0 C--N 1.322 -0.628 0 CA-C-N 116.439 -0.346 . . . . 1.36 110.319 177.474 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_exo -49.92 -32.93 31.93 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.624 2.216 . . . . 0.9 112.079 -179.73 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -64.72 -50.48 66.77 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.64 -0.709 . . . . 2.44 111.429 -179.194 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 75.3 tttt -85.34 -28.22 25.37 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.873 0.368 . . . . 2.33 110.867 -176.047 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.458 ' O ' ' HG3' ' A' ' 21' ' ' GLN . 57.3 tp -61.4 -46.92 88.15 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.115 -0.493 . . . . 1.12 110.238 177.117 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.98 -31.95 72.02 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.153 -0.476 . . . . 1.1 110.719 177.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -65.56 -41.72 92.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.264 0.554 . . . . 3.08 109.897 176.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' 0A1 . . . . . 0.518 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.458 ' HG3' ' O ' ' A' ' 17' ' ' LEU . 97.2 mt-30 -63.35 -41.46 98.86 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.9 -0.591 . . . . 2.56 111.131 178.747 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.03 -40.65 96.79 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.984 -0.553 . . . . 1.13 110.806 178.595 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -69.72 -32.07 70.44 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.254 -0.43 . . . . 0.57 110.152 179.106 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 20' ' ' 0A1 . 59.6 mt -61.31 -30.94 70.8 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 116.152 -0.476 . . . . 1.15 110.794 175.729 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.44 -25.11 67.87 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.11 0.481 . . . . 1.09 110.723 178.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 46.2 mmtm -90.78 -49.13 6.62 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.648 -0.705 . . . . 2.99 109.833 177.108 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' 0A1 . . . . . 0.453 ' CD2' ' HG2' ' A' ' 2' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -64.07 -29.33 70.47 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.71 0.263 . . . . 0.72 111.71 -176.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 61.6 tttp -63.69 -55.8 20.6 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-O 121.024 0.44 . . . . 2.94 110.296 177.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -66.84 -31.99 72.96 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.846 -0.616 . . . . 0.94 110.521 178.378 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 32.5 tp -62.53 -35.94 81.04 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.196 -0.456 . . . . 2.0 110.516 178.646 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.51 -35.74 81.77 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.224 -0.444 . . . . 1.56 110.103 174.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -69.85 -38.05 76.35 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.628 -0.715 . . . . 1.46 110.413 175.589 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.491 0 CA-C-N 116.352 -0.386 . . . . 1.45 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.224 . . . . . . . . 1.66 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 16.4 Cg_exo -65.47 156.58 62.74 Favored 'Trans proline' 0 N--CA 1.463 -0.288 0 C-N-CA 122.67 2.247 . . . . 1.19 111.66 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_exo -70.41 176.25 7.53 Favored 'Trans proline' 0 C--O 1.235 0.338 0 C-N-CA 122.524 2.149 . . . . 0.86 112.084 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.2 p -70.21 101.66 1.92 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.151 -0.477 . . . . 1.31 111.136 178.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 54.0 pttt -90.34 126.44 56.62 Favored Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 116.109 -0.496 . . . . 2.55 111.446 -176.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -75.92 159.24 38.18 Favored 'Trans proline' 0 N--CA 1.461 -0.428 0 C-N-CA 122.725 2.284 . . . . 0.69 112.207 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 9.0 t -72.22 140.65 48.8 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.159 -0.473 . . . . 1.3 111.329 -177.198 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 34.6 mmtp -69.66 129.58 91.19 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 115.596 -0.729 . . . . 2.29 110.661 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.44 ' HA ' ' OD1' ' A' ' 11' ' ' ASN . 58.0 Cg_endo -74.04 97.38 1.0 Allowed 'Trans proline' 0 C--O 1.235 0.363 0 C-N-CA 122.592 2.195 . . . . 1.08 112.877 -179.615 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -101.26 -71.5 0.93 Allowed Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.93 -0.652 . . . . 0.51 111.727 176.361 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -93.99 -20.51 19.91 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.942 0.877 . . . . 2.41 109.196 174.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . 0.506 ' O ' ' HB3' ' A' ' 16' ' ' LYS . 22.2 p-10 -94.73 21.32 7.55 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 114.439 -1.255 . . . . 3.19 109.787 -178.542 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -78.54 19.05 0.5 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.879 -0.601 . . . . 1.05 111.806 -177.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 19.3 p -60.85 149.89 78.95 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 116.099 -0.5 . . . . 1.36 110.541 177.443 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -52.34 -29.06 37.25 Favored 'Trans proline' 0 C--N 1.343 0.274 0 C-N-CA 122.594 2.196 . . . . 0.9 112.731 -179.535 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -65.35 -53.81 38.13 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.099 0.476 . . . . 2.44 110.613 177.038 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.506 ' HB3' ' O ' ' A' ' 11' ' ' ASN . 42.8 tptt -81.15 -32.17 33.81 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.856 -0.611 . . . . 2.33 110.872 -174.533 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.432 ' O ' ' HG2' ' A' ' 21' ' ' GLN . 54.4 tp -62.28 -47.52 83.96 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.168 -0.469 . . . . 1.12 111.086 -179.334 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.07 -31.55 72.83 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.973 0.416 . . . . 1.1 110.192 177.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 57.9 tttm -69.3 -39.46 78.28 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.721 -0.672 . . . . 3.08 109.718 176.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' 0A1 . . . . . 0.465 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.432 ' HG2' ' O ' ' A' ' 17' ' ' LEU . 81.2 mm-40 -62.51 -44.63 95.88 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.013 -0.539 . . . . 2.56 110.895 177.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.92 -25.52 67.91 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.824 -0.625 . . . . 1.13 110.899 178.727 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -80.87 -37.31 30.05 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.425 -0.583 . . . . 0.57 109.425 178.343 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.465 ' HG ' ' O ' ' A' ' 20' ' ' 0A1 . 67.8 mt -61.85 -31.18 71.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.794 -0.639 . . . . 1.15 110.785 176.916 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.71 -30.85 70.21 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.307 0.575 . . . . 1.09 110.668 178.04 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 55.1 mttp -90.38 -46.02 8.64 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.463 -0.79 . . . . 2.99 110.062 178.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.425 ' HA ' ' HB3' ' A' ' 31' ' ' LEU . 99.0 mt-30 -61.04 -30.08 70.1 Favored 'General case' 0 N--CA 1.463 0.217 0 O-C-N 123.029 0.206 . . . . 0.72 111.55 -172.468 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 53.3 tttp -62.05 -53.37 56.54 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-O 121.137 0.494 . . . . 2.94 110.07 177.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -70.34 -33.67 71.76 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.79 -0.641 . . . . 0.94 110.568 178.006 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.425 ' HB3' ' HA ' ' A' ' 28' ' ' GLN . 2.9 tm? -64.34 -37.61 88.13 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.649 -0.705 . . . . 2.0 110.541 -178.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.0 -28.96 69.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.025 0.44 . . . . 1.56 110.715 175.621 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -74.47 -36.04 63.31 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.805 -0.634 . . . . 1.46 109.549 175.54 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.541 0 CA-C-N 116.421 -0.354 . . . . 1.45 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.177 . . . . . . . . 1.66 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_exo -62.22 152.46 76.09 Favored 'Trans proline' 0 C--O 1.235 0.36 0 C-N-CA 122.448 2.099 . . . . 1.19 111.721 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -72.53 172.45 15.08 Favored 'Trans proline' 0 N--CA 1.458 -0.562 0 C-N-CA 122.412 2.075 . . . . 0.86 111.48 179.612 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 7.2 p -70.94 91.04 0.84 Allowed 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 120.942 0.401 . . . . 1.31 111.424 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.414 ' HA ' ' HD3' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -57.98 126.27 76.56 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 116.009 -0.541 . . . . 2.55 110.263 174.316 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 4' ' ' LYS . 10.5 Cg_exo -69.47 157.62 60.27 Favored 'Trans proline' 0 N--CA 1.463 -0.28 0 C-N-CA 122.508 2.139 . . . . 0.69 111.802 -179.251 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 5.6 t -64.81 138.24 58.26 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.078 0.466 . . . . 1.3 109.835 176.232 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.484 ' HD3' ' N ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -79.99 129.9 68.63 Favored Pre-proline 0 C--N 1.318 -0.787 0 CA-C-N 115.949 -0.569 . . . . 2.29 111.103 -175.318 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -71.11 88.6 0.69 Allowed 'Trans proline' 0 C--O 1.235 0.374 0 C-N-CA 122.81 2.34 . . . . 1.08 112.992 179.207 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -101.58 -71.27 0.91 Allowed Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 121.011 -0.614 . . . . 0.51 112.032 176.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -92.87 -25.46 18.07 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.631 0.729 . . . . 2.41 110.3 179.185 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . 0.434 ' C ' ' H ' ' A' ' 13' ' ' THR . 18.2 m120 -97.62 22.19 9.32 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.07 -0.968 . . . . 3.19 110.48 -179.867 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -73.65 31.47 0.07 Allowed 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 112.843 0.683 . . . . 1.05 112.843 -174.502 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.434 ' H ' ' C ' ' A' ' 11' ' ' ASN . 47.9 p -66.1 148.52 98.37 Favored Pre-proline 0 C--N 1.316 -0.874 0 N-CA-C 109.987 -0.375 . . . . 1.36 109.987 176.052 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -53.12 -30.2 49.03 Favored 'Trans proline' 0 C--N 1.342 0.225 0 C-N-CA 122.466 2.111 . . . . 0.9 112.161 179.194 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -64.98 -51.08 63.71 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 116.209 -0.45 . . . . 2.44 111.186 179.422 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 56.4 tttp -79.61 -33.78 41.22 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.17 -0.468 . . . . 2.33 110.512 -177.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.412 ' O ' ' HG3' ' A' ' 21' ' ' GLN . 56.8 tp -60.86 -38.99 87.47 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.843 -0.617 . . . . 1.12 111.06 -179.493 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.18 -35.7 81.14 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.706 0.289 . . . . 1.1 110.471 176.563 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -67.54 -37.55 82.88 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.167 -0.47 . . . . 3.08 109.889 177.333 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' 0A1 . . . . . 0.501 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.412 ' HG3' ' O ' ' A' ' 17' ' ' LEU . 48.4 mt-30 -61.47 -39.18 89.95 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.609 -0.723 . . . . 2.56 110.937 179.051 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.09 -31.39 66.02 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.568 -0.742 . . . . 1.13 111.233 179.308 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -78.53 -23.3 46.3 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.117 0.484 . . . . 0.57 110.03 -179.121 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' A' ' 20' ' ' 0A1 . 75.7 mt -61.99 -25.24 67.52 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.901 -0.59 . . . . 1.15 110.192 173.134 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.47 ' O ' ' HE2' ' A' ' 29' ' ' LYS . . . -64.99 -19.61 66.08 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.04 0.448 . . . . 1.09 110.843 175.727 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 52.1 mttp -90.03 -55.34 3.66 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.221 -0.659 . . . . 2.99 109.221 173.571 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 94.9 mt-30 -63.29 -36.38 83.5 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.759 0.314 . . . . 0.72 111.054 -173.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.47 ' HE2' ' O ' ' A' ' 25' ' ' ALA . 22.4 ttmm -63.31 -53.11 57.86 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 116.18 -0.464 . . . . 2.94 110.383 179.522 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -68.9 -27.88 66.18 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.854 -0.612 . . . . 0.94 110.747 179.661 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 31.3 tp -61.61 -39.65 91.99 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.295 -0.411 . . . . 2.0 110.748 179.435 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.32 -33.45 76.01 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.148 0.499 . . . . 1.56 110.461 176.586 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -74.24 -35.36 63.83 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.624 -0.716 . . . . 1.46 110.339 177.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.512 0 CA-C-N 116.455 -0.338 . . . . 1.45 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.277 . . . . . . . . 1.66 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . 0.421 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . 25.7 Cg_exo -62.24 155.9 53.94 Favored 'Trans proline' 0 C--O 1.234 0.323 0 C-N-CA 122.67 2.247 . . . . 1.19 111.907 . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 1' ' ' PRO . 3.9 Cg_exo -74.23 -176.86 2.9 Favored 'Trans proline' 0 N--CA 1.461 -0.426 0 C-N-CA 122.7 2.267 . . . . 0.86 111.681 177.583 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 12.8 p -72.65 87.79 1.25 Allowed 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.82 -0.627 . . . . 1.31 111.271 179.525 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.43 ' HB3' HMC1 ' A' ' 27' ' ' 0A1 . 0.0 OUTLIER -61.16 123.85 77.68 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 115.949 -0.568 . . . . 2.55 110.826 177.064 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo -76.13 156.0 37.95 Favored 'Trans proline' 0 N--CA 1.459 -0.524 0 C-N-CA 122.594 2.196 . . . . 0.69 111.837 177.371 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 8.1 t -74.67 135.94 41.89 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.275 0.559 . . . . 1.3 110.521 179.637 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 45.8 mmtm -68.93 136.31 89.75 Favored Pre-proline 0 C--N 1.324 -0.527 0 CA-C-N 115.354 -0.839 . . . . 2.29 110.96 -176.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -70.84 81.16 1.12 Allowed 'Trans proline' 0 N--CA 1.459 -0.526 0 C-N-CA 122.422 2.082 . . . . 1.08 113.145 -179.34 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -100.57 -68.76 0.86 Allowed Glycine 0 N--CA 1.444 -0.806 0 N-CA-C 109.973 -1.251 . . . . 0.51 109.973 170.532 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -89.42 -16.16 31.56 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 121.927 0.87 . . . . 2.41 108.92 172.778 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . 0.414 ' O ' ' HB3' ' A' ' 16' ' ' LYS . 0.9 OUTLIER -96.25 21.06 9.44 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 114.76 -1.109 . . . . 3.19 110.128 179.156 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -84.61 14.78 4.27 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.094 -0.503 . . . . 1.05 112.179 -174.453 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 12.8 p -63.28 146.99 95.67 Favored Pre-proline 0 C--N 1.325 -0.494 0 N-CA-C 109.672 -0.492 . . . . 1.36 109.672 174.422 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -51.64 -31.51 40.88 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.306 2.004 . . . . 0.9 112.245 -178.117 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 56.0 mm-40 -66.69 -60.1 3.0 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.94 -0.573 . . . . 2.44 111.183 177.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.414 ' HB3' ' O ' ' A' ' 11' ' ' ASN . 21.2 tptm -72.95 -30.17 63.65 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.819 -0.628 . . . . 2.33 110.676 -173.904 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.456 ' HG ' HE21 ' A' ' 21' ' ' GLN . 60.1 tp -61.24 -46.45 90.34 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.748 -0.66 . . . . 1.12 110.727 177.348 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.26 -38.55 88.09 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.328 -0.396 . . . . 1.1 110.318 178.191 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.495 ' C ' ' HD3' ' A' ' 19' ' ' LYS . 1.0 OUTLIER -60.99 -42.74 98.99 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.949 -0.569 . . . . 3.08 109.47 176.793 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' 0A1 . . . . . 0.474 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.456 HE21 ' HG ' ' A' ' 17' ' ' LEU . 78.4 mt-30 -59.55 -43.37 93.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.181 0.515 . . . . 2.56 110.83 179.578 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -74.31 -29.61 61.7 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.438 -0.801 . . . . 1.13 111.468 -179.006 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -77.74 -24.19 49.13 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.038 0.447 . . . . 0.57 110.178 -179.023 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.474 ' HG ' ' O ' ' A' ' 20' ' ' 0A1 . 60.6 mt -61.89 -31.15 71.41 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.913 -0.585 . . . . 1.15 110.228 173.567 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.61 -22.22 66.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.044 0.45 . . . . 1.09 110.898 178.309 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 56.0 mttp -89.76 -49.68 6.5 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.798 -0.637 . . . . 2.99 109.703 176.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' 0A1 . . . . . 0.43 HMC1 ' HB3' ' A' ' 4' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -64.77 -25.24 67.84 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.139 -0.482 . . . . 0.72 111.886 -174.772 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 55.7 tttp -65.14 -57.68 7.96 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-O 120.843 0.354 . . . . 2.94 110.583 179.097 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -65.01 -34.8 79.31 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.144 -0.48 . . . . 0.94 110.047 178.234 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 20.8 tp -63.14 -40.52 97.81 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.982 -0.554 . . . . 2.0 110.862 179.862 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.82 -36.05 82.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.942 0.401 . . . . 1.56 110.802 178.486 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -72.35 -39.39 68.15 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.938 -0.574 . . . . 1.46 109.768 177.777 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.394 0 CA-C-N 116.645 -0.252 . . . . 1.45 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.211 . . . . . . . . 1.66 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . 0.411 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . 18.9 Cg_exo -64.65 153.45 77.4 Favored 'Trans proline' 0 N--CA 1.46 -0.457 0 C-N-CA 122.498 2.132 . . . . 1.19 111.685 . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.412 ' HD2' HD23 ' A' ' 31' ' ' LEU . 11.1 Cg_exo -69.78 167.94 23.03 Favored 'Trans proline' 0 C--O 1.235 0.362 0 C-N-CA 122.428 2.085 . . . . 0.86 111.32 178.047 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.5 p -68.91 89.74 0.42 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.105 0.479 . . . . 1.31 111.625 -178.534 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.62 131.86 85.69 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 115.543 -0.753 . . . . 2.55 111.091 176.914 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -67.02 151.29 82.19 Favored 'Trans proline' 0 C--O 1.235 0.369 0 C-N-CA 122.916 2.41 . . . . 0.69 112.687 -177.628 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 4.8 t -63.1 134.94 56.85 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.788 -0.642 . . . . 1.3 111.021 178.346 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.435 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 72.7 mmtt -74.11 127.65 87.63 Favored Pre-proline 0 C--N 1.323 -0.565 0 CA-C-N 115.82 -0.627 . . . . 2.29 110.301 -179.401 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' A' ' 7' ' ' LYS . 4.2 Cg_exo -78.59 102.93 1.6 Allowed 'Trans proline' 0 N--CA 1.456 -0.686 0 C-N-CA 122.708 2.272 . . . . 1.08 112.228 179.074 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -100.69 -70.29 0.9 Allowed Glycine 0 N--CA 1.444 -0.778 0 CA-C-N 115.807 -0.633 . . . . 0.51 111.586 175.152 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -87.62 -29.95 20.82 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.424 0.63 . . . . 2.41 110.536 178.814 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . 0.422 ' C ' ' H ' ' A' ' 13' ' ' THR . 19.4 m120 -92.24 21.74 4.96 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.316 -0.856 . . . . 3.19 109.789 -179.545 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -74.65 28.72 0.09 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.413 -0.812 . . . . 1.05 112.774 -174.645 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.422 ' H ' ' C ' ' A' ' 11' ' ' ASN . 32.9 p -70.37 152.54 95.51 Favored Pre-proline 0 C--N 1.316 -0.873 0 N-CA-C 109.65 -0.5 . . . . 1.36 109.65 176.275 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -52.33 -24.74 22.09 Favored 'Trans proline' 0 C--N 1.343 0.272 0 C-N-CA 122.751 2.3 . . . . 0.9 112.601 178.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -62.7 -50.72 70.03 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 116.114 -0.494 . . . . 2.44 110.795 177.633 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 52.6 tttp -89.89 -33.72 16.34 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.164 -0.471 . . . . 2.33 110.687 -177.137 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.595 ' O ' ' HG2' ' A' ' 21' ' ' GLN . 54.1 tp -60.79 -44.63 96.56 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.943 -0.571 . . . . 1.12 111.012 -178.33 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.46 -33.0 74.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.606 0.241 . . . . 1.1 110.85 179.268 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -72.98 -34.4 66.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.234 0.54 . . . . 3.08 109.685 178.194 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' 0A1 . . . . . 0.42 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.595 ' HG2' ' O ' ' A' ' 17' ' ' LEU . 87.8 mm-40 -62.98 -40.53 98.03 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.787 -0.642 . . . . 2.56 110.911 177.695 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.13 -37.51 83.96 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.933 -0.576 . . . . 1.13 110.925 179.27 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -69.4 -35.46 75.79 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.088 -0.505 . . . . 0.57 110.095 178.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 20' ' ' 0A1 . 54.3 mt -61.84 -31.63 71.9 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.026 -0.534 . . . . 1.15 110.833 176.154 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.87 -30.9 71.17 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.235 0.54 . . . . 1.09 110.673 179.128 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 65.8 mttm -90.84 -43.47 10.02 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.368 -0.833 . . . . 2.99 110.594 178.074 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 95.1 mt-30 -61.66 -27.02 68.38 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.845 0.355 . . . . 0.72 110.848 -174.393 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -61.95 -60.14 4.07 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 115.913 -0.585 . . . . 2.94 110.283 178.418 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -68.87 -33.76 74.32 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.844 -0.616 . . . . 0.94 110.902 178.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.412 HD23 ' HD2' ' A' ' 2' ' ' PRO . 3.3 tm? -61.53 -42.42 98.78 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.858 -0.61 . . . . 2.0 110.127 179.849 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -62.44 -42.09 99.2 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.198 -0.456 . . . . 1.56 110.539 177.101 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -63.96 -42.48 97.27 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.731 -0.668 . . . . 1.46 110.826 179.29 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.553 0 CA-C-N 116.342 -0.39 . . . . 1.45 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.262 . . . . . . . . 1.66 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . 0.406 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . 26.8 Cg_exo -62.29 150.79 85.78 Favored 'Trans proline' 0 CA--C 1.531 0.331 0 C-N-CA 122.384 2.056 . . . . 1.19 111.825 . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.407 ' HG3' ' OD1' ' A' ' 30' ' ' ASP . 3.1 Cg_exo -78.67 176.84 9.42 Favored 'Trans proline' 0 N--CA 1.46 -0.471 0 C-N-CA 122.802 2.334 . . . . 0.86 111.947 -178.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 9.3 p -66.31 100.36 0.62 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.087 -0.506 . . . . 1.31 110.998 179.524 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.418 ' HB3' ' CE2' ' A' ' 27' ' ' 0A1 . 23.8 pttm -80.48 127.74 74.85 Favored Pre-proline 0 C--O 1.236 0.365 0 CA-C-N 116.335 -0.393 . . . . 2.55 110.577 -179.438 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.428 ' HB2' ' HD2' ' A' ' 20' ' ' 0A1 . 4.1 Cg_exo -75.39 158.0 40.87 Favored 'Trans proline' 0 N--CA 1.46 -0.465 0 C-N-CA 122.675 2.25 . . . . 0.69 112.6 -175.858 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.8 t -67.03 140.88 57.69 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.695 -0.684 . . . . 1.3 110.479 178.451 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.424 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 45.5 mmtm -80.12 128.55 73.08 Favored Pre-proline 0 C--N 1.319 -0.74 0 CA-C-N 115.943 -0.571 . . . . 2.29 110.51 -178.035 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' A' ' 7' ' ' LYS . 1.9 Cg_endo -81.32 94.99 0.94 Allowed 'Trans proline' 0 N--CA 1.452 -0.946 0 C-N-CA 122.367 2.045 . . . . 1.08 112.132 178.771 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -98.08 -69.1 0.94 Allowed Glycine 0 N--CA 1.446 -0.692 0 N-CA-C 111.071 -0.812 . . . . 0.51 111.071 176.758 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -93.64 -20.51 20.12 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 121.717 0.77 . . . . 2.41 109.536 173.37 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . 0.443 ' C ' ' H ' ' A' ' 13' ' ' THR . 16.2 m120 -92.69 21.38 5.55 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.043 -0.98 . . . . 3.19 109.897 179.691 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -75.79 24.34 0.12 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.6 -0.727 . . . . 1.05 112.088 -176.305 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.443 ' H ' ' C ' ' A' ' 11' ' ' ASN . 13.2 p -61.51 149.26 84.44 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 116.057 -0.52 . . . . 1.36 110.454 175.711 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -49.27 -35.79 35.61 Favored 'Trans proline' 0 C--N 1.343 0.248 0 C-N-CA 122.921 2.414 . . . . 0.9 112.405 -179.474 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 23.7 mm-40 -63.78 -54.15 39.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.988 -0.551 . . . . 2.44 111.63 -179.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 52.2 tptt -74.48 -34.72 63.19 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.208 0.528 . . . . 2.33 110.162 -176.57 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.496 ' O ' ' HG2' ' A' ' 21' ' ' GLN . 55.9 tp -61.91 -40.89 97.0 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.46 -0.791 . . . . 1.12 110.721 179.64 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.17 -40.97 95.01 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.765 0.317 . . . . 1.1 110.594 178.522 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 27.9 tptp -64.37 -38.49 91.23 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.135 -0.484 . . . . 3.08 110.042 177.556 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' 0A1 . . . . . 0.528 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.496 ' HG2' ' O ' ' A' ' 17' ' ' LEU . 78.7 mm-40 -60.87 -45.35 94.91 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.999 -0.546 . . . . 2.56 110.965 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.31 -27.82 65.72 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.821 -0.627 . . . . 1.13 111.611 -177.622 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -82.83 -26.61 31.53 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.138 0.494 . . . . 0.57 109.978 -178.54 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.528 ' HG ' ' O ' ' A' ' 20' ' ' 0A1 . 73.0 mt -62.83 -28.37 69.96 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.873 -0.603 . . . . 1.15 110.684 175.087 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.14 -26.09 68.12 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.496 0.665 . . . . 1.09 110.455 177.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 39.3 mtpt -87.38 -53.65 4.71 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.143 -0.935 . . . . 2.99 109.835 176.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' 0A1 . . . . . 0.418 ' CE2' ' HB3' ' A' ' 4' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -62.18 -25.19 67.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.566 -0.288 . . . . 0.72 111.697 -172.168 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 61.4 tttp -63.39 -65.57 0.66 Allowed 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 116.373 -0.376 . . . . 2.94 110.63 179.161 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.407 ' OD1' ' HG3' ' A' ' 2' ' ' PRO . 27.9 t70 -67.04 -30.74 70.9 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.318 -0.401 . . . . 0.94 110.634 179.84 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -61.4 -46.62 89.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.213 -0.449 . . . . 2.0 110.475 -179.637 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.29 -34.66 78.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.229 -0.441 . . . . 1.56 111.12 179.035 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -72.89 -39.19 66.6 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.031 0.443 . . . . 1.46 110.627 179.457 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.458 0 CA-C-N 116.377 -0.374 . . . . 1.45 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.155 . . . . . . . . 1.66 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -62.34 163.52 20.26 Favored 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 122.536 2.158 . . . . 1.19 111.767 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 14.9 Cg_exo -68.03 177.91 3.96 Favored 'Trans proline' 0 C--O 1.234 0.277 0 C-N-CA 122.29 1.994 . . . . 0.86 110.765 173.152 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 7.7 p -57.13 104.64 0.17 Allowed 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 110.232 -0.285 . . . . 1.31 110.232 175.612 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 46.8 pttt -88.79 135.71 31.77 Favored Pre-proline 0 C--N 1.322 -0.627 0 CA-C-O 120.963 0.411 . . . . 2.55 111.153 -174.328 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -78.97 141.23 16.55 Favored 'Trans proline' 0 N--CA 1.452 -0.959 0 C-N-CA 122.47 2.113 . . . . 0.69 111.341 -179.578 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 9.0 t -62.76 139.82 58.71 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.085 0.469 . . . . 1.3 110.704 -177.882 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 34.6 mmtp -73.18 129.76 85.65 Favored Pre-proline 0 C--N 1.324 -0.532 0 CA-C-N 115.497 -0.774 . . . . 2.29 110.358 -177.421 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -75.46 92.21 1.02 Allowed 'Trans proline' 0 N--CA 1.457 -0.622 0 C-N-CA 122.503 2.135 . . . . 1.08 112.359 -179.78 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -98.43 -70.44 0.98 Allowed Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 120.819 -0.705 . . . . 0.51 111.432 177.142 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -93.41 -24.15 18.16 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-O 121.545 0.688 . . . . 2.41 110.22 176.29 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -93.17 22.16 5.32 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.277 -0.874 . . . . 3.19 110.092 -178.48 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -75.99 23.82 0.13 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.731 -0.668 . . . . 1.05 112.536 -175.222 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 15.5 p -64.41 148.93 95.73 Favored Pre-proline 0 C--N 1.321 -0.641 0 CA-C-N 116.437 -0.347 . . . . 1.36 110.305 177.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -51.84 -31.69 43.53 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.677 2.251 . . . . 0.9 112.344 -179.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -62.4 -45.1 94.64 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.609 -0.723 . . . . 2.44 111.096 179.631 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 48.1 tttp -90.8 -34.32 15.36 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.413 -0.358 . . . . 2.33 111.24 -176.725 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.449 ' O ' ' HG2' ' A' ' 21' ' ' GLN . 54.8 tp -59.77 -39.35 84.57 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.259 -0.428 . . . . 1.12 111.034 -176.552 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.89 -37.17 85.4 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.743 0.306 . . . . 1.1 110.648 177.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 27.9 tptp -65.38 -41.14 94.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.205 -0.452 . . . . 3.08 109.919 176.48 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' 0A1 . . . . . 0.469 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.449 ' HG2' ' O ' ' A' ' 17' ' ' LEU . 83.7 mm-40 -62.05 -46.71 87.92 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.128 -0.487 . . . . 2.56 111.016 179.135 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.1 -33.71 76.67 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.929 -0.578 . . . . 1.13 111.234 -179.785 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -74.44 -29.27 61.42 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.14 -0.482 . . . . 0.57 110.254 179.688 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 20' ' ' 0A1 . 68.4 mt -63.96 -31.23 72.35 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.263 -0.426 . . . . 1.15 110.762 176.062 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.52 -26.73 68.71 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.523 0.678 . . . . 1.09 110.159 176.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 59.1 mttm -87.82 -46.69 9.22 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.061 -0.972 . . . . 2.99 109.67 177.189 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 93.9 mt-30 -63.42 -32.44 73.88 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.503 -0.317 . . . . 0.72 111.372 -174.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 56.2 tptt -65.64 -53.94 34.43 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-O 120.916 0.389 . . . . 2.94 110.419 177.29 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -65.23 -30.75 71.66 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.318 0.58 . . . . 0.94 110.291 179.371 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 23.1 tp -62.57 -34.24 76.57 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.498 -0.774 . . . . 2.0 110.799 178.519 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.81 -30.75 71.76 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.085 -0.507 . . . . 1.56 111.083 178.606 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -72.95 -26.78 61.5 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.094 0.473 . . . . 1.46 110.298 178.148 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.497 0 CA-C-N 116.451 -0.341 . . . . 1.45 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.23 . . . . . . . . 1.66 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -63.12 155.32 61.86 Favored 'Trans proline' 0 C--O 1.236 0.403 0 C-N-CA 122.411 2.074 . . . . 1.19 112.54 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.534 ' HG2' ' CD2' ' A' ' 27' ' ' 0A1 . 37.9 Cg_endo -68.41 175.26 7.12 Favored 'Trans proline' 0 C--O 1.233 0.229 0 C-N-CA 123.1 2.534 . . . . 0.86 112.641 -179.5 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 6.5 p -63.74 108.92 1.55 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.909 -0.587 . . . . 1.31 111.386 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.414 ' HA ' ' HD3' ' A' ' 5' ' ' PRO . 57.2 pttt -93.58 142.81 25.64 Favored Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 116.476 -0.329 . . . . 2.55 110.814 -179.605 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 4' ' ' LYS . 22.2 Cg_endo -84.52 179.28 4.53 Favored 'Trans proline' 0 N--CA 1.457 -0.674 0 C-N-CA 122.669 2.246 . . . . 0.69 112.683 -176.474 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 9.8 t -93.92 149.83 20.89 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.336 -0.393 . . . . 1.3 110.072 177.458 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.485 ' HZ3' ' CM ' ' A' ' 20' ' ' 0A1 . 68.4 mmtt -82.25 130.27 60.32 Favored Pre-proline 0 C--N 1.326 -0.425 0 CA-C-O 120.624 0.25 . . . . 2.29 110.732 -177.474 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.453 ' HD3' ' HA ' ' A' ' 7' ' ' LYS . 7.2 Cg_exo -72.14 105.75 1.9 Allowed 'Trans proline' 0 C--O 1.235 0.352 0 C-N-CA 122.765 2.31 . . . . 1.08 112.602 178.124 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -95.78 -70.98 1.08 Allowed Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.903 -0.665 . . . . 0.51 111.623 176.736 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -95.37 -18.19 20.96 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.775 0.798 . . . . 2.41 109.649 176.139 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 18.3 m120 -93.33 21.0 6.45 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.028 -0.987 . . . . 3.19 109.67 178.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -78.09 16.08 0.81 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.479 -0.782 . . . . 1.05 111.982 -174.554 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 23.8 p -68.25 153.31 95.69 Favored Pre-proline 0 C--N 1.322 -0.599 0 CA-C-N 116.171 -0.468 . . . . 1.36 110.045 174.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_exo -51.29 -22.34 11.4 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 123.023 2.482 . . . . 0.9 113.02 -179.351 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -62.63 -62.91 1.42 Allowed 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 116.302 -0.408 . . . . 2.44 111.425 178.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -82.96 -27.66 30.35 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.923 0.392 . . . . 2.33 110.691 -177.269 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.527 ' O ' ' HG2' ' A' ' 21' ' ' GLN . 55.7 tp -60.12 -40.65 90.5 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.984 -0.553 . . . . 1.12 110.829 179.457 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.8 -36.42 80.4 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.77 0.319 . . . . 1.1 110.634 177.148 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -64.48 -40.48 95.75 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.633 -0.506 . . . . 3.08 109.633 176.624 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' 0A1 . . . . . 0.485 ' CM ' ' HZ3' ' A' ' 7' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.527 ' HG2' ' O ' ' A' ' 17' ' ' LEU . 85.7 mm-40 -62.66 -43.51 98.62 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.115 -0.493 . . . . 2.56 110.698 177.296 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.95 -36.77 84.55 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.734 -0.666 . . . . 1.13 111.01 178.016 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -68.88 -37.59 79.12 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.726 -0.472 . . . . 0.57 109.726 178.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.454 ' HG ' ' O ' ' A' ' 20' ' ' 0A1 . 79.1 mt -63.02 -28.32 70.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.697 -0.683 . . . . 1.15 110.979 177.009 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.98 -26.98 69.1 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.226 0.536 . . . . 1.09 110.564 177.258 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 51.8 mtmt -89.27 -51.17 5.71 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.586 -0.733 . . . . 2.99 109.861 176.432 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' 0A1 . . . . . 0.534 ' CD2' ' HG2' ' A' ' 2' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -64.17 -23.83 67.46 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.668 -0.242 . . . . 0.72 111.634 -173.202 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 60.6 tttp -63.84 -57.37 10.08 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 121.185 0.517 . . . . 2.94 110.06 177.754 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.431 ' HB3' ' HG3' ' A' ' 2' ' ' PRO . 14.1 t70 -67.75 -36.78 81.15 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.489 -0.778 . . . . 0.94 110.466 178.522 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -64.28 -38.39 90.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.399 -0.819 . . . . 2.0 110.822 -177.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.0 -30.5 71.49 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.146 0.498 . . . . 1.56 110.947 178.393 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -79.26 -37.55 37.65 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.878 -0.601 . . . . 1.46 110.421 178.14 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.374 0 CA-C-N 116.273 -0.422 . . . . 1.45 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.203 . . . . . . . . 1.66 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . 0.408 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . 16.9 Cg_exo -65.44 155.23 69.87 Favored 'Trans proline' 0 N--CA 1.461 -0.416 0 C-N-CA 122.497 2.131 . . . . 1.19 111.595 . . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 1' ' ' PRO . 4.6 Cg_exo -72.16 179.51 4.89 Favored 'Trans proline' 0 N--CA 1.46 -0.486 0 C-N-CA 122.533 2.155 . . . . 0.86 110.952 176.243 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 11.7 p -62.87 94.7 0.07 Allowed 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.955 0.407 . . . . 1.31 110.466 176.458 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.462 ' HA ' ' HD3' ' A' ' 5' ' ' PRO . 6.6 ptmm? -75.33 125.82 88.46 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-N 115.929 -0.578 . . . . 2.55 110.977 -175.617 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.462 ' HD3' ' HA ' ' A' ' 4' ' ' LYS . 2.5 Cg_endo -81.1 166.43 18.64 Favored 'Trans proline' 0 N--CA 1.454 -0.803 0 C-N-CA 122.628 2.219 . . . . 0.69 112.12 -178.064 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.1 t -78.89 138.54 38.17 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.026 -0.534 . . . . 1.3 110.565 179.672 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 48.6 mmtm -74.81 128.71 84.84 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-N 115.818 -0.628 . . . . 2.29 110.028 177.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.453 ' HA ' ' OD1' ' A' ' 11' ' ' ASN . 58.7 Cg_endo -75.3 84.72 1.66 Allowed 'Trans proline' 0 N--CA 1.46 -0.477 0 C-N-CA 122.642 2.228 . . . . 1.08 113.201 -176.886 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -101.77 -71.81 0.93 Allowed Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.879 -0.676 . . . . 0.51 111.819 174.419 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -94.05 6.44 48.53 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.341 0.591 . . . . 2.41 109.809 177.319 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . 0.453 ' OD1' ' HA ' ' A' ' 8' ' ' PRO . 10.2 p30 -126.55 20.51 7.25 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.227 -0.897 . . . . 3.19 109.719 -179.503 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -79.43 29.62 0.24 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.129 -0.941 . . . . 1.05 113.009 -170.493 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 6.8 p -64.43 143.64 98.52 Favored Pre-proline 0 C--N 1.316 -0.859 0 N-CA-C 109.897 -0.408 . . . . 1.36 109.897 175.445 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -50.24 -32.96 34.57 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.834 2.356 . . . . 0.9 112.304 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 51.7 mm-40 -63.09 -48.04 80.29 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.739 -0.664 . . . . 2.44 111.208 179.209 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.508 ' HZ1' ' HB2' ' A' ' 16' ' ' LYS . 3.8 ttmp? -84.03 -32.12 25.05 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.369 -0.378 . . . . 2.33 110.51 -177.526 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.518 ' O ' ' HG3' ' A' ' 21' ' ' GLN . 57.5 tp -59.61 -46.22 89.63 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.983 -0.553 . . . . 1.12 110.799 179.258 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.34 -36.84 85.43 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.428 -0.351 . . . . 1.1 110.626 177.732 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 57.6 tptt -65.07 -41.27 95.24 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.163 -0.472 . . . . 3.08 110.146 177.04 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' 0A1 . . . . . 0.586 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.518 ' HG3' ' O ' ' A' ' 17' ' ' LEU . 97.5 mt-30 -62.06 -41.02 97.7 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.717 -0.674 . . . . 2.56 110.899 179.467 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.52 -34.9 72.81 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.897 -0.592 . . . . 1.13 110.983 178.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -70.81 -29.88 66.17 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.767 -0.457 . . . . 0.57 109.767 179.568 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.586 ' HG ' ' O ' ' A' ' 20' ' ' 0A1 . 71.3 mt -61.36 -28.82 69.5 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.877 -0.601 . . . . 1.15 110.593 176.02 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.47 -29.24 70.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.332 0.586 . . . . 1.09 110.572 177.818 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 64.5 mttm -91.24 -47.57 7.43 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.226 -0.897 . . . . 2.99 110.21 177.46 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.412 ' HA ' ' HB3' ' A' ' 31' ' ' LEU . 97.8 mt-30 -65.38 -21.44 66.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.529 -0.305 . . . . 0.72 111.509 -174.757 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -64.76 -57.98 7.48 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-O 121.009 0.433 . . . . 2.94 110.078 176.565 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -66.42 -33.31 75.43 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.256 0.55 . . . . 0.94 110.093 178.304 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.412 ' HB3' ' HA ' ' A' ' 28' ' ' GLN . 18.6 tp -62.29 -36.27 81.59 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.612 -0.722 . . . . 2.0 110.971 179.355 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.93 -36.1 80.39 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.282 -0.417 . . . . 1.56 111.009 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -78.04 -33.58 50.95 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.0 0.429 . . . . 1.46 110.145 177.148 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.475 0 CA-C-N 116.59 -0.277 . . . . 1.45 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.195 . . . . . . . . 1.66 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -65.07 168.07 14.73 Favored 'Trans proline' 0 C--O 1.237 0.45 0 C-N-CA 123.019 2.479 . . . . 1.19 112.191 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.407 ' HG2' ' CD2' ' A' ' 27' ' ' 0A1 . 60.9 Cg_endo -78.5 -179.46 5.47 Favored 'Trans proline' 0 C--O 1.235 0.335 0 C-N-CA 122.626 2.218 . . . . 0.86 112.251 178.464 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 4.5 p -63.04 97.77 0.12 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.83 -0.623 . . . . 1.31 111.999 -178.89 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.36 128.8 86.82 Favored Pre-proline 0 N--CA 1.448 -0.542 0 CA-C-N 116.137 -0.483 . . . . 2.55 110.192 176.715 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -71.35 158.0 55.4 Favored 'Trans proline' 0 C--O 1.237 0.471 0 C-N-CA 122.542 2.162 . . . . 0.69 112.258 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 10.2 t -64.55 139.89 58.81 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.904 -0.589 . . . . 1.3 110.161 178.686 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 43.2 mmtm -81.55 129.41 65.88 Favored Pre-proline 0 C--N 1.321 -0.633 0 CA-C-N 116.093 -0.503 . . . . 2.29 110.898 -175.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_endo -77.65 89.97 1.29 Allowed 'Trans proline' 0 N--CA 1.457 -0.65 0 C-N-CA 122.816 2.344 . . . . 1.08 112.691 179.796 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -101.45 -70.71 0.89 Allowed Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.831 -0.7 . . . . 0.51 111.374 174.5 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -88.96 -25.29 22.13 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 121.525 0.679 . . . . 2.41 110.021 176.366 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -96.31 21.56 8.88 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.217 -0.901 . . . . 3.19 109.322 -179.999 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -74.29 13.96 0.5 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.49 -0.777 . . . . 1.05 112.125 -177.009 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 17.4 p -57.75 151.25 43.26 Favored Pre-proline 0 C--N 1.323 -0.557 0 CA-C-N 116.156 -0.475 . . . . 1.36 110.394 175.43 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -58.36 -18.19 37.08 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.71 2.273 . . . . 0.9 112.17 -176.605 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -63.14 -57.24 11.24 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.652 -0.704 . . . . 2.44 110.204 177.463 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 66.0 tttt -91.13 -23.32 20.32 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.524 -0.762 . . . . 2.33 111.115 -174.625 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.46 ' O ' ' HG3' ' A' ' 21' ' ' GLN . 54.9 tp -59.8 -41.98 92.44 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.268 -0.424 . . . . 1.12 110.79 179.833 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.45 -35.67 75.88 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.927 0.394 . . . . 1.1 110.63 177.46 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -67.19 -37.49 83.77 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.217 -0.447 . . . . 3.08 109.916 178.707 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' 0A1 . . . . . 0.504 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.46 ' HG3' ' O ' ' A' ' 17' ' ' LEU . 78.2 mt-30 -60.77 -45.12 95.56 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.853 -0.612 . . . . 2.56 110.586 177.013 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.61 -31.02 72.06 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.534 -0.757 . . . . 1.13 111.298 179.865 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -77.13 -33.15 56.82 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.928 0.394 . . . . 0.57 109.943 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.504 ' HG ' ' O ' ' A' ' 20' ' ' 0A1 . 71.2 mt -60.61 -29.49 69.25 Favored 'General case' 0 C--O 1.225 -0.211 0 CA-C-N 115.963 -0.562 . . . . 1.15 110.639 176.913 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.66 -26.4 68.63 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.185 0.517 . . . . 1.09 110.799 178.138 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt -91.28 -48.55 6.85 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.65 -0.705 . . . . 2.99 110.251 176.255 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' 0A1 . . . . . 0.407 ' CD2' ' HG2' ' A' ' 2' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -64.42 -31.36 72.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.512 -0.313 . . . . 0.72 110.926 -176.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 19.0 ttmm -61.06 -54.64 42.24 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-O 121.258 0.551 . . . . 2.94 110.286 178.88 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -68.14 -36.98 80.57 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.489 -0.778 . . . . 0.94 110.377 179.093 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 19.1 tp -62.77 -37.99 88.83 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.918 -0.583 . . . . 2.0 110.92 -179.342 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.99 -36.68 85.17 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.056 0.455 . . . . 1.56 110.758 176.27 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -71.9 -37.28 70.14 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.818 -0.628 . . . . 1.46 110.334 177.65 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.555 0 CA-C-N 116.349 -0.387 . . . . 1.45 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.256 . . . . . . . . 1.66 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -62.49 155.33 58.69 Favored 'Trans proline' 0 C--O 1.237 0.444 0 C-N-CA 122.68 2.253 . . . . 1.19 112.542 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.48 ' HG2' ' CD2' ' A' ' 27' ' ' 0A1 . 35.6 Cg_endo -67.71 176.9 4.59 Favored 'Trans proline' 0 C--O 1.235 0.355 0 C-N-CA 122.967 2.445 . . . . 0.86 112.718 -179.501 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 39.8 p -66.79 103.01 1.02 Allowed 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.892 -0.595 . . . . 1.31 111.129 -179.033 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.452 ' HA ' ' HD3' ' A' ' 5' ' ' PRO . 58.7 pttt -83.48 135.06 44.11 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 116.377 -0.374 . . . . 2.55 110.9 -178.72 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' A' ' 4' ' ' LYS . 10.0 Cg_exo -71.03 148.28 56.53 Favored 'Trans proline' 0 N--CA 1.46 -0.488 0 C-N-CA 122.508 2.139 . . . . 0.69 112.39 -179.431 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 5.1 t -69.87 136.5 50.75 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.913 -0.585 . . . . 1.3 109.799 176.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 44.5 mmtm -69.54 149.7 96.99 Favored Pre-proline 0 C--N 1.324 -0.517 0 CA-C-N 115.596 -0.729 . . . . 2.29 112.058 -170.099 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -61.58 65.7 0.1 Allowed 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 123.523 2.815 . . . . 1.08 114.053 174.024 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -92.94 -69.83 1.13 Allowed Glycine 0 C--N 1.31 -0.892 0 N-CA-C 109.415 -1.474 . . . . 0.51 109.415 166.629 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -97.68 2.1 49.34 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 108.75 -0.833 . . . . 2.41 108.75 168.5 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 52.1 m-80 -104.9 19.48 20.48 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.141 -0.936 . . . . 3.19 110.005 -179.542 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -95.42 6.37 49.17 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.327 -0.397 . . . . 1.05 111.266 -175.662 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 11.8 p -64.3 145.59 98.17 Favored Pre-proline 0 C--N 1.325 -0.487 0 N-CA-C 109.458 -0.571 . . . . 1.36 109.458 172.058 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_exo -49.07 -37.17 37.44 Favored 'Trans proline' 0 C--O 1.233 0.244 0 C-N-CA 122.339 2.026 . . . . 0.9 112.309 -178.551 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 24.3 mm-40 -68.21 -48.86 64.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.771 -0.649 . . . . 2.44 111.56 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 22.1 tptp -82.85 -26.71 31.39 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.057 -0.52 . . . . 2.33 110.81 -174.159 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 48.1 tp -64.15 -41.6 97.11 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.03 -0.532 . . . . 1.12 110.269 177.524 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.99 -38.22 87.94 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.886 -0.597 . . . . 1.1 110.006 175.803 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 56.2 tptt -65.48 -38.98 91.37 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.723 -0.672 . . . . 3.08 110.38 176.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 74.5 mm-40 -63.01 -46.58 86.93 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.148 -0.478 . . . . 2.56 111.251 178.218 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.49 -38.16 88.81 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.596 -0.729 . . . . 1.13 111.25 179.429 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 28.2 t0 -73.91 -29.44 62.05 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.122 0.487 . . . . 0.57 110.158 -179.672 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 30.4 mt -62.62 -32.82 73.92 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 115.99 -0.55 . . . . 1.15 110.676 173.795 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.88 -34.09 74.09 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.141 0.496 . . . . 1.09 110.509 -179.719 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -79.33 -46.02 18.49 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.483 -0.78 . . . . 2.99 110.211 177.535 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' 0A1 . . . . . 0.48 ' CD2' ' HG2' ' A' ' 2' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.409 ' HA ' ' HB3' ' A' ' 31' ' ' LEU . 96.7 mt-30 -64.82 -23.9 67.38 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.622 -0.263 . . . . 0.72 111.56 -174.801 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 39.6 ttmt -63.06 -58.93 5.62 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 121.081 0.467 . . . . 2.94 110.476 177.284 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -68.15 -32.65 73.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.739 -0.664 . . . . 0.94 110.244 178.793 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.409 ' HB3' ' HA ' ' A' ' 28' ' ' GLN . 23.0 tp -62.96 -33.29 75.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.677 -0.692 . . . . 2.0 111.332 179.534 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.27 -29.3 70.65 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.954 0.406 . . . . 1.56 110.844 178.665 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -79.77 -36.86 36.53 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.068 -0.515 . . . . 1.46 109.678 176.312 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.456 0 CA-C-N 116.582 -0.281 . . . . 1.45 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.244 . . . . . . . . 1.66 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_exo -66.04 165.16 24.89 Favored 'Trans proline' 0 C--O 1.236 0.423 0 C-N-CA 122.954 2.436 . . . . 1.19 112.189 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_exo -64.59 167.77 14.54 Favored 'Trans proline' 0 C--O 1.237 0.448 0 C-N-CA 122.692 2.261 . . . . 0.86 111.58 175.211 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 18.2 p -67.22 111.14 3.79 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 109.974 -0.38 . . . . 1.31 109.974 176.461 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -87.57 147.91 42.84 Favored Pre-proline 0 N--CA 1.449 -0.492 0 CA-C-O 120.755 0.312 . . . . 2.55 110.956 -175.747 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_endo -84.24 167.45 12.21 Favored 'Trans proline' 0 N--CA 1.453 -0.879 0 C-N-CA 122.902 2.401 . . . . 0.69 112.025 -176.694 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 11.1 t -88.69 138.8 31.09 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 109.69 -0.485 . . . . 1.3 109.69 176.508 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.456 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 33.2 mmtp -79.16 128.12 76.99 Favored Pre-proline 0 C--N 1.317 -0.845 0 CA-C-N 116.008 -0.542 . . . . 2.29 109.805 -178.944 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.456 ' HD3' ' HA ' ' A' ' 7' ' ' LYS . 0.9 OUTLIER -79.12 94.32 1.07 Allowed 'Trans proline' 0 N--CA 1.455 -0.768 0 C-N-CA 122.235 1.957 . . . . 1.08 112.48 -178.715 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -101.2 -71.18 0.92 Allowed Glycine 0 N--CA 1.445 -0.745 0 C-N-CA 120.922 -0.656 . . . . 0.51 111.48 175.492 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -85.35 -29.48 24.45 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 121.492 0.663 . . . . 2.41 110.311 178.054 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . 0.5 ' C ' ' H ' ' A' ' 13' ' ' THR . 18.9 t-20 -95.68 22.35 7.3 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.373 -0.83 . . . . 3.19 109.281 179.67 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -71.97 31.71 0.05 Allowed 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.569 0.581 . . . . 1.05 112.569 -177.438 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.5 ' H ' ' C ' ' A' ' 11' ' ' ASN . 40.5 p -59.96 151.07 66.74 Favored Pre-proline 0 C--N 1.318 -0.765 0 CA-C-N 115.841 -0.618 . . . . 1.36 109.982 174.92 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_exo -50.75 -34.42 44.23 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.38 2.053 . . . . 0.9 111.846 178.338 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -66.59 -56.24 11.64 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.594 -0.73 . . . . 2.44 111.523 179.387 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 17.0 tppt? -70.28 -35.41 73.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.238 0.542 . . . . 2.33 110.373 -176.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.637 ' O ' ' HG3' ' A' ' 21' ' ' GLN . 57.7 tp -60.59 -46.81 88.86 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.376 -0.829 . . . . 1.12 110.035 177.143 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.42 -37.11 86.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.109 -0.496 . . . . 1.1 110.659 178.165 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 29.9 tttm -59.94 -49.8 76.25 Favored 'General case' 0 C--O 1.222 -0.343 0 CA-C-N 116.095 -0.502 . . . . 3.08 109.659 175.817 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' 0A1 . . . . . 0.515 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.637 ' HG3' ' O ' ' A' ' 17' ' ' LEU . 92.5 mt-30 -60.91 -43.9 97.91 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.082 -0.508 . . . . 2.56 111.001 -179.484 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -77.54 -26.25 50.87 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.054 -0.521 . . . . 1.13 111.129 -179.434 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -77.84 -24.3 48.7 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.022 -0.535 . . . . 0.57 110.353 -179.001 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.515 ' HG ' ' O ' ' A' ' 20' ' ' 0A1 . 66.9 mt -63.13 -31.11 72.17 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.218 -0.446 . . . . 1.15 110.201 173.464 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.45 -19.86 66.12 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.932 -0.576 . . . . 1.09 110.649 176.771 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 30.0 mmmt -90.3 -52.86 4.71 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.603 -0.726 . . . . 2.99 109.578 175.523 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -65.04 -28.03 69.2 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.555 0.217 . . . . 0.72 111.574 -175.599 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 25.2 ttmm -65.27 -54.02 35.52 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-O 120.924 0.392 . . . . 2.94 110.419 177.018 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -66.93 -30.89 71.15 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.349 0.595 . . . . 0.94 110.112 177.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 20.3 tp -63.13 -32.82 74.3 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.399 -0.819 . . . . 2.0 111.08 177.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.41 -32.27 73.66 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.288 -0.415 . . . . 1.56 111.189 178.818 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -80.72 -29.97 36.33 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.383 0.611 . . . . 1.46 109.833 177.513 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.497 0 CA-C-N 116.346 -0.388 . . . . 1.45 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.203 . . . . . . . . 1.66 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -66.87 161.77 40.73 Favored 'Trans proline' 0 C--O 1.234 0.313 0 C-N-CA 122.764 2.309 . . . . 1.19 112.27 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.428 ' HG2' ' CD2' ' A' ' 27' ' ' 0A1 . 56.8 Cg_endo -78.18 177.56 8.63 Favored 'Trans proline' 0 N--CA 1.46 -0.448 0 C-N-CA 122.522 2.148 . . . . 0.86 111.792 176.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 19.0 p -59.64 110.12 1.06 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.255 -0.43 . . . . 1.31 111.261 179.764 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 16.3 ptmt -94.78 131.88 29.63 Favored Pre-proline 0 C--N 1.325 -0.5 0 CA-C-O 120.936 0.398 . . . . 2.55 110.773 -179.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -78.28 144.49 20.69 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 122.256 1.97 . . . . 0.69 111.807 179.688 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 6.0 t -64.27 143.71 57.69 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.978 -0.555 . . . . 1.3 111.128 -177.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 49.0 mmtm -65.28 128.82 94.13 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 116.006 -0.543 . . . . 2.29 110.804 -179.129 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -81.9 92.81 0.97 Allowed 'Trans proline' 0 N--CA 1.456 -0.704 0 C-N-CA 122.416 2.077 . . . . 1.08 112.249 175.593 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -100.09 -70.77 0.94 Allowed Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 120.623 -0.798 . . . . 0.51 111.594 177.379 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -90.12 -20.79 22.72 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 121.605 0.717 . . . . 2.41 110.17 178.156 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 15.4 m120 -99.48 21.2 12.51 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.24 -0.891 . . . . 3.19 110.003 -179.842 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -79.64 31.79 0.24 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.903 -0.59 . . . . 1.05 112.522 -174.566 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 17.1 p -58.64 150.59 56.53 Favored Pre-proline 0 C--N 1.319 -0.743 0 CA-C-N 116.229 -0.442 . . . . 1.36 110.353 175.369 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_exo -50.65 -38.95 56.65 Favored 'Trans proline' 0 C--N 1.343 0.279 0 C-N-CA 122.562 2.174 . . . . 0.9 112.197 -179.446 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 37.3 mm-40 -67.99 -42.06 81.37 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 115.941 -0.572 . . . . 2.44 111.932 -177.82 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 59.4 tttm -82.99 -28.38 29.73 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.149 0.499 . . . . 2.33 110.252 -178.389 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.462 ' O ' ' HG3' ' A' ' 21' ' ' GLN . 51.1 tp -63.24 -44.31 95.56 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.685 -0.689 . . . . 1.12 110.81 178.435 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.94 -36.34 83.09 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.912 0.387 . . . . 1.1 110.21 176.46 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -63.36 -39.61 95.0 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.917 -0.583 . . . . 3.08 110.227 175.871 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' 0A1 . . . . . 0.514 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.462 ' HG3' ' O ' ' A' ' 17' ' ' LEU . 76.8 mt-30 -62.67 -42.97 99.9 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.911 -0.586 . . . . 2.56 110.895 177.665 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.19 -36.29 83.14 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.744 -0.662 . . . . 1.13 111.158 179.647 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.453 ' HA ' ' HE2' ' A' ' 26' ' ' LYS . 7.4 t70 -74.87 -31.04 61.51 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.067 0.461 . . . . 0.57 109.867 179.118 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.514 ' HG ' ' O ' ' A' ' 20' ' ' 0A1 . 69.2 mt -63.16 -29.95 71.2 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.964 -0.562 . . . . 1.15 110.608 174.651 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.75 -28.6 69.55 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.368 0.604 . . . . 1.09 110.701 178.51 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.453 ' HE2' ' HA ' ' A' ' 23' ' ' ASP . 48.7 mtmt -89.84 -46.18 8.74 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.499 -0.773 . . . . 2.99 110.157 176.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' 0A1 . . . . . 0.428 ' CD2' ' HG2' ' A' ' 2' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 99.1 mt-30 -61.57 -29.1 69.8 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 112.051 0.389 . . . . 0.72 112.051 -171.005 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 60.4 tttm -63.22 -59.38 4.82 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 121.051 0.453 . . . . 2.94 110.449 179.086 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -68.51 -33.39 74.05 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.961 -0.563 . . . . 0.94 110.722 179.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -63.7 -34.36 77.68 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.918 -0.583 . . . . 2.0 110.184 178.686 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.8 -36.43 83.48 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.171 -0.468 . . . . 1.56 111.015 177.167 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -79.42 -21.02 46.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.137 0.494 . . . . 1.46 110.37 179.548 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.484 0 CA-C-N 116.217 -0.447 . . . . 1.45 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.323 . . . . . . . . 1.1699999999999999 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 16.1 Cg_exo -66.1 162.27 36.35 Favored 'Trans proline' 0 N--CA 1.463 -0.304 0 C-N-CA 122.736 2.291 . . . . 0.96999999999999997 111.739 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.43 ' HG2' ' CD2' ' A' ' 27' ' ' 0A1 . 59.5 Cg_endo -79.37 179.8 6.07 Favored 'Trans proline' 0 N--CA 1.457 -0.659 0 C-N-CA 122.464 2.109 . . . . 0.56000000000000005 112.118 179.759 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 2.2 p -62.9 102.44 0.35 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.908 -0.587 . . . . 0.69999999999999996 110.95 177.879 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 25.1 pttm -90.44 125.07 61.03 Favored Pre-proline 0 N--CA 1.449 -0.516 0 CA-C-O 120.899 0.381 . . . . 1.96 110.727 179.516 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -77.97 157.45 30.78 Favored 'Trans proline' 0 N--CA 1.458 -0.566 0 C-N-CA 122.634 2.223 . . . . 0.44 112.284 -178.894 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 9.3 t -72.55 145.99 47.05 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.023 -0.535 . . . . 0.79000000000000004 110.285 177.904 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.462 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 34.4 mmtp -79.16 129.66 71.93 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-N 116.058 -0.519 . . . . 1.6799999999999999 110.603 -177.083 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.462 ' HD3' ' HA ' ' A' ' 7' ' ' LYS . 2.4 Cg_endo -78.12 98.23 1.19 Allowed 'Trans proline' 0 N--CA 1.458 -0.615 0 C-N-CA 122.358 2.039 . . . . 0.72999999999999998 112.109 178.858 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -100.96 -70.77 0.91 Allowed Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.887 -0.673 . . . . 0.51000000000000001 111.443 175.639 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -84.74 -27.13 27.15 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.563 0.697 . . . . 2.4100000000000001 110.19 178.102 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ASN . . . . . 0.403 ' HB3' ' HD3' ' A' ' 16' ' ' LYS . 16.6 m120 -96.53 21.28 9.45 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.086 -0.961 . . . . 2.4900000000000002 110.138 -178.433 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -76.39 32.15 0.13 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.689 -0.687 . . . . 0.41999999999999998 112.672 -175.043 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 40.6 p -62.5 151.04 84.29 Favored Pre-proline 0 C--N 1.319 -0.741 0 CA-C-N 116.237 -0.438 . . . . 0.73999999999999999 109.893 175.338 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -52.27 -30.17 41.19 Favored 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.501 2.134 . . . . 0.68000000000000005 112.087 179.391 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -67.5 -58.25 5.07 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.408 -0.814 . . . . 2.4399999999999999 111.178 179.601 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.403 ' HD3' ' HB3' ' A' ' 11' ' ' ASN . 61.2 tttm -74.51 -29.91 61.59 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.103 0.477 . . . . 1.8 110.477 -175.772 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.462 ' O ' ' HG2' ' A' ' 21' ' ' GLN . 56.7 tp -61.52 -38.72 88.4 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.87 -0.604 . . . . 0.35999999999999999 110.252 176.184 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.67 -37.49 82.43 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.238 -0.437 . . . . 0.27000000000000002 110.392 177.462 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 45.3 tttp -61.01 -44.73 96.98 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.359 0.599 . . . . 2.54 109.678 175.681 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' 0A1 . . . . . 0.574 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.462 ' HG2' ' O ' ' A' ' 17' ' ' LEU . 86.6 mm-40 -62.63 -41.67 99.15 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.193 -0.458 . . . . 1.99 111.271 179.415 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.3 -30.86 70.83 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.924 -0.58 . . . . 0.38 110.922 179.684 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -79.07 -30.36 43.92 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.169 -0.468 . . . . 0.56999999999999995 110.049 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.574 ' HG ' ' O ' ' A' ' 20' ' ' 0A1 . 65.4 mt -61.42 -27.18 68.36 Favored 'General case' 0 CA--C 1.521 -0.173 0 CA-C-N 115.898 -0.592 . . . . 0.32000000000000001 110.563 175.852 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.05 -30.65 70.45 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.257 0.551 . . . . 0.37 110.627 177.594 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -90.96 -45.9 8.47 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.409 -0.814 . . . . 2.48 110.66 178.059 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' 0A1 . . . . . 0.446 HMC2 ' HE1' ' A' ' 27' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -63.57 -23.28 67.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.451 -0.34 . . . . 0.71999999999999997 111.427 -172.725 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 47.4 tttm -64.39 -57.7 8.56 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 116.16 -0.473 . . . . 2.3599999999999999 110.624 176.659 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -68.62 -34.73 76.26 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.126 0.489 . . . . 0.93999999999999995 110.454 178.055 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -62.78 -39.19 93.44 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.591 -0.731 . . . . 1.3300000000000001 110.422 -178.643 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.3 -36.12 83.07 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 120.943 0.401 . . . . 1.0800000000000001 110.99 178.133 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -70.38 -43.52 69.92 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.14 -0.482 . . . . 1.46 109.881 177.129 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.458 0 CA-C-N 116.572 -0.285 . . . . 1.1399999999999999 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.2 . . . . . . . . 1.1699999999999999 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -71.4 145.48 48.08 Favored 'Trans proline' 0 N--CA 1.452 -0.949 0 C-N-CA 122.282 1.988 . . . . 0.96999999999999997 111.979 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.474 ' HG2' ' CD2' ' A' ' 27' ' ' 0A1 . 41.9 Cg_endo -71.28 -179.41 3.56 Favored 'Trans proline' 0 C--O 1.235 0.335 0 C-N-CA 122.594 2.196 . . . . 0.56000000000000005 112.161 178.731 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 19.7 p -63.42 99.07 0.18 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.019 -0.537 . . . . 0.69999999999999996 111.048 178.825 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.439 ' HD3' ' H ' ' A' ' 4' ' ' LYS . 0.1 OUTLIER -81.89 129.45 64.7 Favored Pre-proline 0 C--N 1.323 -0.558 0 CA-C-N 116.282 -0.417 . . . . 1.96 110.677 179.069 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -78.88 141.66 17.05 Favored 'Trans proline' 0 N--CA 1.458 -0.587 0 C-N-CA 122.298 1.998 . . . . 0.44 111.827 177.014 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 6.1 t -65.2 141.4 58.67 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.787 -0.449 . . . . 0.79000000000000004 109.787 176.567 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.408 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 27.3 mmtp -80.54 129.59 68.15 Favored Pre-proline 0 C--N 1.321 -0.655 0 CA-C-N 116.277 -0.419 . . . . 1.6799999999999999 110.487 -173.089 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 7' ' ' LYS . 10.3 Cg_exo -69.69 110.2 2.48 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.766 2.311 . . . . 0.72999999999999998 112.699 -176.683 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -100.96 -69.36 0.86 Allowed Glycine 0 N--CA 1.448 -0.551 0 C-N-CA 120.911 -0.661 . . . . 0.51000000000000001 111.56 175.608 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -90.51 -28.87 18.26 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.418 0.628 . . . . 2.4100000000000001 110.584 179.358 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 30.5 p-10 -92.6 20.94 5.83 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.28 -0.873 . . . . 2.4900000000000002 109.974 -178.316 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -77.74 31.56 0.16 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.221 -0.899 . . . . 0.41999999999999998 112.379 -175.026 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 12.0 p -64.03 151.83 88.97 Favored Pre-proline 0 C--N 1.318 -0.795 0 CA-C-N 116.129 -0.487 . . . . 0.73999999999999999 109.974 173.957 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -57.07 -31.19 89.51 Favored 'Trans proline' 0 C--O 1.233 0.26 0 C-N-CA 122.559 2.173 . . . . 0.68000000000000005 111.785 -177.516 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -63.06 -49.37 74.81 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 115.827 -0.624 . . . . 2.4399999999999999 110.796 178.891 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.506 ' O ' ' HD3' ' A' ' 16' ' ' LYS . 9.4 tmtt? -81.42 -33.47 32.16 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.983 -0.553 . . . . 1.8 109.747 -177.005 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.402 ' O ' ' HG3' ' A' ' 21' ' ' GLN . 46.4 tp -61.59 -41.69 97.78 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.824 -0.626 . . . . 0.35999999999999999 111.203 -179.342 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.84 -38.28 88.45 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.789 0.328 . . . . 0.27000000000000002 110.537 177.552 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -63.39 -41.48 98.76 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.837 -0.619 . . . . 2.54 109.917 176.303 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' 0A1 . . . . . 0.474 ' HE1' HMC2 ' A' ' 20' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.402 ' HG3' ' O ' ' A' ' 17' ' ' LEU . 51.1 mt-30 -63.22 -42.37 99.27 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.238 -0.437 . . . . 1.99 111.028 177.364 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.75 -39.38 93.96 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.78 -0.645 . . . . 0.38 110.804 178.673 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -70.33 -32.93 70.87 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.024 -0.535 . . . . 0.56999999999999995 110.367 178.487 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 42.3 mt -61.89 -32.85 73.26 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 116.341 -0.391 . . . . 0.32000000000000001 110.867 176.808 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.93 -25.17 68.2 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.181 0.515 . . . . 0.37 110.617 178.875 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 44.2 mmtm -90.23 -44.38 9.77 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.582 -0.735 . . . . 2.48 109.938 177.762 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' 0A1 . . . . . 0.474 ' CD2' ' HG2' ' A' ' 2' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 97.2 mt-30 -63.93 -27.66 69.3 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.404 -0.362 . . . . 0.71999999999999997 111.134 -176.098 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 58.6 tttm -64.01 -54.64 31.17 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 120.934 0.397 . . . . 2.3599999999999999 110.619 178.153 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -67.43 -34.86 78.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.096 0.474 . . . . 0.93999999999999995 110.052 178.634 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 21.1 tp -63.2 -34.65 78.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.771 -0.649 . . . . 1.3300000000000001 110.261 177.413 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.37 -32.2 73.56 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.879 -0.601 . . . . 1.0800000000000001 110.664 176.343 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -77.18 -29.42 54.41 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.209 0.528 . . . . 1.46 109.876 177.184 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' 0A1 . . . . . 0.401 HMC2 ' HE1' ' A' ' 34' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.607 0 CA-C-N 116.244 -0.435 . . . . 1.1399999999999999 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.079 . . . . . . . . 1.1699999999999999 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -61.93 167.85 9.82 Favored 'Trans proline' 0 C--O 1.235 0.362 0 C-N-CA 122.931 2.421 . . . . 0.96999999999999997 112.452 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.457 ' HB3' ' OD1' ' A' ' 30' ' ' ASP . 23.2 Cg_endo -64.11 -178.28 0.59 Allowed 'Trans proline' 0 C--O 1.234 0.275 0 C-N-CA 122.614 2.209 . . . . 0.56000000000000005 111.907 174.598 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 22.6 p -61.31 99.98 0.12 Allowed 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.991 -0.549 . . . . 0.69999999999999996 110.814 178.373 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.5 ' HA ' ' HD3' ' A' ' 5' ' ' PRO . 0.2 OUTLIER -82.92 140.74 43.37 Favored Pre-proline 0 N--CA 1.449 -0.521 0 C-N-CA 120.857 -0.337 . . . . 1.96 110.645 -178.815 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.508 ' HB2' ' HD2' ' A' ' 20' ' ' 0A1 . 7.6 Cg_endo -86.62 154.85 8.99 Favored 'Trans proline' 0 N--CA 1.453 -0.897 0 C-N-CA 122.832 2.355 . . . . 0.44 112.326 -176.304 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 13.5 t -70.06 147.54 49.89 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.068 -0.514 . . . . 0.79000000000000004 110.288 178.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 42.4 mmtm -88.21 130.94 44.17 Favored Pre-proline 0 C--N 1.322 -0.608 0 CA-C-N 116.392 -0.367 . . . . 1.6799999999999999 110.632 -174.716 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.44 ' HA ' ' ND2' ' A' ' 11' ' ' ASN . 43.6 Cg_endo -69.76 97.02 0.61 Allowed 'Trans proline' 0 C--O 1.233 0.233 0 C-N-CA 122.627 2.218 . . . . 0.72999999999999998 113.076 -178.41 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -100.44 -72.3 0.99 Allowed Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.362 -0.923 . . . . 0.51000000000000001 111.275 174.268 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -100.0 2.47 43.5 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.583 0.706 . . . . 2.4100000000000001 109.69 175.586 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ASN . . . . . 0.477 ' HB2' ' HD3' ' A' ' 16' ' ' LYS . 5.7 p-10 -113.43 21.54 15.07 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 114.878 -1.055 . . . . 2.4900000000000002 109.691 -179.101 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -77.2 14.01 1.01 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.232 -0.894 . . . . 0.41999999999999998 111.887 -175.528 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 1.1 p -60.42 141.49 91.42 Favored Pre-proline 0 N--CA 1.449 -0.504 0 CA-C-N 115.949 -0.569 . . . . 0.73999999999999999 110.561 172.296 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_exo -50.7 -32.4 36.07 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 123.054 2.503 . . . . 0.68000000000000005 113.103 -174.836 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 21.5 mm-40 -62.2 -47.7 83.29 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.531 -0.304 . . . . 2.4399999999999999 111.334 -177.605 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.477 ' HD3' ' HB2' ' A' ' 11' ' ' ASN . 77.3 tttt -90.36 -28.59 18.6 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.086 0.47 . . . . 1.8 110.279 -178.945 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.505 ' O ' ' HG2' ' A' ' 21' ' ' GLN . 62.7 tp -62.25 -45.88 91.32 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.792 -0.64 . . . . 0.35999999999999999 110.878 178.456 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.55 -29.45 67.04 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.946 0.403 . . . . 0.27000000000000002 110.649 177.656 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt -68.99 -36.71 78.15 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.345 -0.613 . . . . 2.54 109.345 175.25 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' 0A1 . . . . . 0.508 ' HD2' ' HB2' ' A' ' 5' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.505 ' HG2' ' O ' ' A' ' 17' ' ' LEU . 78.1 mm-40 -62.22 -41.17 98.14 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.108 0.48 . . . . 1.99 110.664 178.664 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.52 -30.85 66.4 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.75 -0.659 . . . . 0.38 111.113 178.86 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -74.34 -31.6 62.49 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.601 -0.518 . . . . 0.56999999999999995 109.601 177.848 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' A' ' 20' ' ' 0A1 . 62.9 mt -62.89 -31.42 72.47 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.104 -0.498 . . . . 0.32000000000000001 110.493 174.047 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.19 -22.76 66.94 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.151 0.501 . . . . 0.37 110.615 177.073 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.446 ' O ' ' HB3' ' A' ' 29' ' ' LYS . 58.4 mttp -90.63 -43.98 9.82 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.458 -0.792 . . . . 2.48 109.814 175.165 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.407 ' HA ' ' HB3' ' A' ' 31' ' ' LEU . 79.3 mt-30 -64.2 -23.29 67.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.843 0.354 . . . . 0.71999999999999997 111.015 -177.809 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.446 ' HB3' ' O ' ' A' ' 26' ' ' LYS . 83.0 tttt -63.55 -61.02 2.6 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.9 -0.591 . . . . 2.3599999999999999 110.511 175.845 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.457 ' OD1' ' HB3' ' A' ' 2' ' ' PRO . 16.2 t70 -66.81 -32.11 73.18 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.208 0.528 . . . . 0.93999999999999995 110.205 179.261 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.407 ' HB3' ' HA ' ' A' ' 28' ' ' GLN . 18.3 tp -60.8 -31.42 70.82 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.541 -0.754 . . . . 1.3300000000000001 110.759 179.549 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -62.96 -28.93 70.42 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.865 -0.607 . . . . 1.0800000000000001 111.47 178.867 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -86.47 -26.13 24.81 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.373 0.606 . . . . 1.46 109.835 177.526 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.525 0 CA-C-N 116.315 -0.402 . . . . 1.1399999999999999 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.207 . . . . . . . . 1.1699999999999999 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.454 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . 22.6 Cg_exo -63.62 154.51 68.6 Favored 'Trans proline' 0 C--O 1.235 0.326 0 C-N-CA 122.715 2.277 . . . . 0.96999999999999997 111.793 . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.454 ' HD3' ' HA ' ' A' ' 1' ' ' PRO . 5.8 Cg_exo -74.26 176.04 10.15 Favored 'Trans proline' 0 N--CA 1.46 -0.479 0 C-N-CA 122.592 2.195 . . . . 0.56000000000000005 111.618 179.818 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 19.7 p -65.83 98.88 0.43 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.18 -0.464 . . . . 0.69999999999999996 110.709 177.139 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.566 ' HB3' ' CE2' ' A' ' 27' ' ' 0A1 . 13.6 ptmt -88.05 127.31 58.0 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-N 116.095 -0.502 . . . . 1.96 111.294 -177.825 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -84.19 136.11 6.64 Favored 'Trans proline' 0 N--CA 1.452 -0.944 0 C-N-CA 122.463 2.109 . . . . 0.44 111.158 176.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 14.2 t -68.0 157.69 34.53 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.366 -0.379 . . . . 0.79000000000000004 110.21 -178.631 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.404 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 1.0 OUTLIER -78.46 128.1 78.73 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-N 116.344 -0.389 . . . . 1.6799999999999999 110.729 -175.41 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 7' ' ' LYS . 6.5 Cg_exo -73.45 121.51 7.2 Favored 'Trans proline' 0 N--CA 1.463 -0.268 0 C-N-CA 122.647 2.231 . . . . 0.72999999999999998 111.788 176.529 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -100.27 -72.12 0.99 Allowed Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.486 -0.864 . . . . 0.51000000000000001 112.013 179.291 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -99.29 -14.65 19.14 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 121.713 0.768 . . . . 2.4100000000000001 109.751 177.083 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 19.3 p-10 -93.65 20.28 7.64 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 114.933 -1.031 . . . . 2.4900000000000002 109.369 177.381 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -85.55 22.99 1.44 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.124 -0.944 . . . . 0.41999999999999998 111.564 -175.239 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 35.6 p -55.26 146.86 39.28 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 116.058 -0.519 . . . . 0.73999999999999999 110.385 177.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -48.29 -31.49 17.4 Favored 'Trans proline' 0 C--N 1.343 0.288 0 C-N-CA 122.723 2.282 . . . . 0.68000000000000005 112.222 178.752 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -64.65 -54.1 37.16 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.851 -0.613 . . . . 2.4399999999999999 111.48 177.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 15.2 tptm -81.94 -30.8 31.61 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.189 -0.459 . . . . 1.8 110.546 -174.881 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.448 ' O ' ' HG3' ' A' ' 21' ' ' GLN . 40.9 tp -62.52 -35.52 79.67 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.936 -0.575 . . . . 0.35999999999999999 110.519 177.971 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.35 -31.94 73.32 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.328 -0.397 . . . . 0.27000000000000002 110.669 177.456 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -72.63 -38.37 67.74 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.646 -0.501 . . . . 2.54 109.646 176.114 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' 0A1 . . . . . 0.505 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.448 ' HG3' ' O ' ' A' ' 17' ' ' LEU . 28.3 mt-30 -61.48 -49.5 76.51 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.961 -0.563 . . . . 1.99 110.741 177.281 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.33 -31.8 73.05 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.616 -0.72 . . . . 0.38 111.461 -179.288 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -76.71 -29.75 56.37 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.174 0.512 . . . . 0.56999999999999995 109.797 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' A' ' 20' ' ' 0A1 . 61.3 mt -63.38 -27.96 69.67 Favored 'General case' 0 C--O 1.225 -0.233 0 CA-C-N 115.803 -0.635 . . . . 0.32000000000000001 110.777 174.408 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.55 -30.15 71.1 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.234 0.54 . . . . 0.37 110.483 178.375 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 72.6 mttt -78.96 -54.53 5.94 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.825 0.822 . . . . 2.48 109.175 175.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' 0A1 . . . . . 0.566 ' CE2' ' HB3' ' A' ' 4' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -62.27 -30.54 71.19 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.512 -0.313 . . . . 0.71999999999999997 111.794 -170.299 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -61.05 -57.97 10.35 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-O 120.756 0.313 . . . . 2.3599999999999999 110.459 179.33 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.431 ' OD1' ' HG3' ' A' ' 2' ' ' PRO . 38.2 t70 -69.48 -33.18 72.49 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.522 -0.308 . . . . 0.93999999999999995 110.661 178.429 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.409 ' HG ' ' CZ ' ' A' ' 27' ' ' 0A1 . 3.2 tm? -62.9 -39.21 93.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.396 -0.365 . . . . 1.3300000000000001 110.622 -178.87 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.4 -34.44 78.17 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.325 -0.398 . . . . 1.0800000000000001 111.062 178.432 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -82.23 -27.34 32.56 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.319 0.58 . . . . 1.46 110.199 178.84 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' 0A1 . . . . . 0.436 ' HE1' HMC2 ' A' ' 34' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.376 0 CA-C-N 116.591 -0.277 . . . . 1.1399999999999999 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.178 . . . . . . . . 1.1699999999999999 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.441 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . 21.2 Cg_exo -64.53 156.69 59.27 Favored 'Trans proline' 0 C--O 1.235 0.342 0 C-N-CA 122.692 2.261 . . . . 0.96999999999999997 111.971 . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' A' ' 1' ' ' PRO . 14.8 Cg_exo -68.54 -177.64 1.57 Allowed 'Trans proline' 0 C--O 1.235 0.369 0 C-N-CA 122.85 2.367 . . . . 0.56000000000000005 112.171 177.805 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 21.8 p -69.16 94.9 0.71 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.927 -0.579 . . . . 0.69999999999999996 110.275 176.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 55.8 pttt -79.56 137.51 55.17 Favored Pre-proline 0 C--N 1.322 -0.594 0 CA-C-N 116.138 -0.483 . . . . 1.96 110.921 -178.079 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -73.42 151.5 48.01 Favored 'Trans proline' 0 N--CA 1.458 -0.614 0 C-N-CA 122.185 1.923 . . . . 0.44 112.015 178.859 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 4.4 t -67.97 135.09 51.82 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.021 -0.536 . . . . 0.79000000000000004 110.752 178.417 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -73.07 128.73 87.37 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.826 -0.625 . . . . 1.6799999999999999 110.18 179.618 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.448 ' HA ' ' OD1' ' A' ' 11' ' ' ASN . 61.3 Cg_endo -76.71 83.18 2.13 Favored 'Trans proline' 0 N--CA 1.458 -0.56 0 C-N-CA 122.415 2.077 . . . . 0.72999999999999998 112.669 -179.042 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -101.21 -71.25 0.92 Allowed Glycine 0 N--CA 1.447 -0.609 0 CA-C-N 115.537 -0.756 . . . . 0.51000000000000001 111.586 175.843 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.4 m-20 -94.33 -9.86 34.57 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.548 0.69 . . . . 2.4100000000000001 109.703 177.894 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ASN . . . . . 0.448 ' OD1' ' HA ' ' A' ' 8' ' ' PRO . 25.2 p-10 -112.86 22.34 14.57 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.845 -1.071 . . . . 2.4900000000000002 110.239 -178.264 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.07 32.49 0.06 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.466 -0.788 . . . . 0.41999999999999998 112.929 -175.79 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.405 ' H ' ' C ' ' A' ' 11' ' ' ASN . 65.3 p -62.8 149.27 89.98 Favored Pre-proline 0 C--N 1.317 -0.818 0 N-CA-C 110.109 -0.33 . . . . 0.73999999999999999 110.109 175.76 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -51.76 -33.93 52.25 Favored 'Trans proline' 0 C--O 1.232 0.218 0 C-N-CA 122.423 2.082 . . . . 0.68000000000000005 112.043 178.206 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -67.99 -53.64 24.53 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.633 -0.712 . . . . 2.4399999999999999 111.238 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 17.1 tppt? -73.05 -32.7 65.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.908 -0.587 . . . . 1.8 110.311 -177.045 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.417 ' O ' ' HG3' ' A' ' 21' ' ' GLN . 62.3 tp -61.92 -42.32 98.96 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.687 -0.688 . . . . 0.35999999999999999 110.803 177.608 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -70.35 -33.99 72.11 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.39 -0.368 . . . . 0.27000000000000002 110.125 175.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 56.5 tptt -64.4 -40.79 96.49 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.005 -0.543 . . . . 2.54 110.08 175.656 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' 0A1 . . . . . 0.577 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.417 ' HG3' ' O ' ' A' ' 17' ' ' LEU . 78.5 mt-30 -62.27 -48.69 78.78 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.678 -0.692 . . . . 1.99 110.763 177.83 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.62 -33.82 76.51 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.746 -0.661 . . . . 0.38 111.311 -178.347 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -72.46 -30.29 64.43 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.184 -0.462 . . . . 0.56999999999999995 110.074 -179.607 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.577 ' HG ' ' O ' ' A' ' 20' ' ' 0A1 . 71.3 mt -61.11 -31.62 71.31 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 116.231 -0.44 . . . . 0.32000000000000001 110.581 175.758 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.08 -28.74 70.29 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.252 0.549 . . . . 0.37 110.709 178.686 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp -90.85 -44.65 9.27 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.465 -0.789 . . . . 2.48 110.448 177.81 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' 0A1 . . . . . 0.429 ' HE1' HMC2 ' A' ' 27' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -63.48 -29.85 71.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.844 0.354 . . . . 0.71999999999999997 111.266 -174.915 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 62.9 tttp -64.35 -51.98 60.64 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 115.956 -0.565 . . . . 2.3599999999999999 110.35 177.717 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -67.5 -36.75 81.67 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.793 -0.639 . . . . 0.93999999999999995 110.299 177.696 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 34.7 tp -61.36 -34.1 74.74 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.599 -0.728 . . . . 1.3300000000000001 111.089 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.45 -29.54 70.59 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.02 0.438 . . . . 1.0800000000000001 110.84 177.038 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -78.72 -28.85 45.09 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.008 -0.542 . . . . 1.46 110.078 179.452 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.452 0 CA-C-N 116.44 -0.345 . . . . 1.1399999999999999 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.13 . . . . . . . . 1.1699999999999999 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_exo -63.87 166.67 15.56 Favored 'Trans proline' 0 C--O 1.234 0.306 0 C-N-CA 122.78 2.32 . . . . 0.96999999999999997 112.088 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.501 ' HB3' ' OD1' ' A' ' 30' ' ' ASP . 16.9 Cg_exo -67.63 174.52 7.35 Favored 'Trans proline' 0 C--O 1.233 0.245 0 C-N-CA 122.591 2.194 . . . . 0.56000000000000005 111.744 175.755 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.1 p -69.24 94.07 0.67 Allowed 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.182 0.515 . . . . 0.69999999999999996 110.881 177.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.465 ' HA ' ' HD3' ' A' ' 5' ' ' PRO . 11.3 ptmm? -79.42 132.84 61.11 Favored Pre-proline 0 C--N 1.326 -0.422 0 CA-C-N 115.77 -0.65 . . . . 1.96 110.95 -176.388 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.465 ' HD3' ' HA ' ' A' ' 4' ' ' LYS . 3.4 Cg_endo -85.31 167.27 10.6 Favored 'Trans proline' 0 N--CA 1.459 -0.511 0 C-N-CA 122.958 2.439 . . . . 0.44 111.821 -178.903 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 14.2 t -75.38 150.41 38.39 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 110.185 -0.302 . . . . 0.79000000000000004 110.185 179.691 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.5 mptm? -86.22 136.76 35.39 Favored Pre-proline 0 C--N 1.322 -0.613 0 CA-C-N 116.246 -0.433 . . . . 1.6799999999999999 110.846 -178.058 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.506 ' HA ' ' OD1' ' A' ' 11' ' ' ASN . 36.3 Cg_endo -77.36 93.2 1.09 Allowed 'Trans proline' 0 N--CA 1.453 -0.866 0 C-N-CA 122.498 2.132 . . . . 0.72999999999999998 112.807 -179.546 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -97.43 -71.14 1.04 Allowed Glycine 0 N--CA 1.448 -0.5 0 C-N-CA 120.612 -0.804 . . . . 0.51000000000000001 111.367 175.248 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -97.5 -7.77 30.73 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.502 0.668 . . . . 2.4100000000000001 109.546 174.392 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ASN . . . . . 0.506 ' OD1' ' HA ' ' A' ' 8' ' ' PRO . 9.8 p30 -102.56 20.73 16.57 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.313 -0.858 . . . . 2.4900000000000002 109.496 175.58 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.415 ' HA ' ' HB2' ' A' ' 8' ' ' PRO . . . -77.74 20.15 0.35 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.48 -0.782 . . . . 0.41999999999999998 111.306 -178.943 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 62.0 p -59.18 149.17 69.03 Favored Pre-proline 0 C--N 1.323 -0.558 0 CA-C-N 115.531 -0.759 . . . . 0.73999999999999999 110.334 176.525 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_exo -51.09 -34.64 48.23 Favored 'Trans proline' 0 C--O 1.233 0.242 0 C-N-CA 122.344 2.029 . . . . 0.68000000000000005 112.236 178.521 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 42.5 mm-40 -66.92 -52.72 39.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.993 -0.549 . . . . 2.4399999999999999 111.431 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.511 ' O ' ' HD3' ' A' ' 16' ' ' LYS . 6.7 tmtm? -78.23 -33.39 49.88 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.179 -0.464 . . . . 1.8 109.902 -174.462 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.451 ' O ' ' HG2' ' A' ' 21' ' ' GLN . 49.2 tp -59.96 -44.94 94.12 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.067 -0.515 . . . . 0.35999999999999999 110.549 179.708 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.51 -29.9 70.93 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.057 -0.52 . . . . 0.27000000000000002 110.717 178.717 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 48.0 tptt -74.65 -40.1 61.65 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.047 -0.524 . . . . 2.54 109.828 178.89 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' 0A1 . . . . . 0.483 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.451 ' HG2' ' O ' ' A' ' 17' ' ' LEU . 80.5 mm-40 -61.25 -43.93 98.07 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.018 -0.537 . . . . 1.99 110.74 176.733 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.16 -37.76 86.43 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.703 -0.68 . . . . 0.38 111.144 178.69 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -75.65 -30.57 59.49 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.822 0.344 . . . . 0.56999999999999995 110.336 179.376 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 20' ' ' 0A1 . 49.7 mt -62.66 -32.37 73.42 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 116.459 -0.337 . . . . 0.32000000000000001 110.688 176.002 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.46 -23.36 67.37 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.33 0.586 . . . . 0.37 110.377 176.956 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 88.9 mttt -90.36 -48.54 7.06 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.425 -0.807 . . . . 2.48 109.696 176.672 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -64.63 -32.79 74.61 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.735 0.303 . . . . 0.71999999999999997 110.904 -175.917 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 59.5 tttm -65.13 -50.43 66.07 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 116.104 -0.498 . . . . 2.3599999999999999 110.212 175.807 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.501 ' OD1' ' HB3' ' A' ' 2' ' ' PRO . 30.4 t70 -65.76 -30.52 71.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.794 -0.639 . . . . 0.93999999999999995 110.282 177.955 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 18.3 tp -62.69 -40.46 97.17 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.775 -0.648 . . . . 1.3300000000000001 110.574 176.745 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.76 -35.41 80.63 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.096 -0.502 . . . . 1.0800000000000001 111.111 178.006 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -72.98 -39.99 65.66 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.003 0.43 . . . . 1.46 110.234 177.606 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' 0A1 . . . . . 0.456 ' HE1' HMC2 ' A' ' 34' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.553 0 CA-C-N 116.546 -0.297 . . . . 1.1399999999999999 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.228 -0.055 . . . . . . . . 1.1699999999999999 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -63.49 159.26 41.24 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.752 2.301 . . . . 0.96999999999999997 113.172 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.432 ' HG2' ' CD2' ' A' ' 27' ' ' 0A1 . 34.7 Cg_endo -68.94 175.29 7.6 Favored 'Trans proline' 0 N--CA 1.464 -0.235 0 C-N-CA 122.742 2.295 . . . . 0.56000000000000005 111.62 175.728 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 6.2 p -61.41 107.52 0.79 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.435 -0.348 . . . . 0.69999999999999996 111.326 179.85 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -89.4 122.4 68.47 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 116.121 -0.49 . . . . 1.96 110.666 -178.714 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.437 ' HB2' ' HD2' ' A' ' 20' ' ' 0A1 . 57.1 Cg_endo -74.25 147.61 37.71 Favored 'Trans proline' 0 N--CA 1.459 -0.514 0 C-N-CA 122.359 2.04 . . . . 0.44 112.313 -178.642 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 9.3 t -73.74 148.22 42.81 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.853 -0.612 . . . . 0.79000000000000004 110.616 -179.464 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp -73.66 130.19 84.07 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 116.447 -0.342 . . . . 1.6799999999999999 110.516 -179.277 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -72.87 96.46 0.85 Allowed 'Trans proline' 0 N--CA 1.462 -0.338 0 C-N-CA 122.577 2.185 . . . . 0.72999999999999998 112.28 -179.91 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -100.65 -70.91 0.93 Allowed Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.794 -0.717 . . . . 0.51000000000000001 112.65 179.714 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -93.77 -24.12 17.92 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.601 0.715 . . . . 2.4100000000000001 110.249 -178.613 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -99.26 21.35 12.05 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.218 -0.901 . . . . 2.4900000000000002 109.765 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.38 23.99 0.05 Allowed 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 113.174 0.805 . . . . 0.41999999999999998 113.174 -172.896 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 16.2 p -53.13 149.34 13.0 Favored Pre-proline 0 C--N 1.322 -0.609 0 O-C-N 123.151 0.282 . . . . 0.73999999999999999 110.772 174.331 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -55.53 -32.21 81.78 Favored 'Trans proline' 0 N--CA 1.464 -0.231 0 C-N-CA 122.813 2.342 . . . . 0.68000000000000005 111.93 -176.801 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -63.95 -52.07 61.46 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.755 -0.657 . . . . 2.4399999999999999 110.566 178.791 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 56.3 tttm -75.63 -31.55 59.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.034 -0.53 . . . . 1.8 110.199 -177.631 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.544 ' O ' ' HG2' ' A' ' 21' ' ' GLN . 62.1 tp -62.82 -48.93 76.95 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.73 -0.668 . . . . 0.35999999999999999 110.961 -179.793 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.53 -32.84 73.9 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.931 0.396 . . . . 0.27000000000000002 110.51 177.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt -67.47 -36.52 81.29 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.632 -0.507 . . . . 2.54 109.632 177.034 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' 0A1 . . . . . 0.48 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.544 ' HG2' ' O ' ' A' ' 17' ' ' LEU . 82.4 mm-40 -63.41 -41.96 98.73 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.978 -0.555 . . . . 1.99 110.842 178.613 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.23 -34.23 77.03 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.111 -0.495 . . . . 0.38 110.797 178.032 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -70.18 -33.36 71.64 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.964 -0.562 . . . . 0.56999999999999995 110.185 178.789 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.48 ' HG ' ' O ' ' A' ' 20' ' ' 0A1 . 58.0 mt -61.9 -32.8 73.22 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.951 -0.568 . . . . 0.32000000000000001 110.752 176.738 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.71 -25.64 68.29 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.991 -0.55 . . . . 0.37 110.819 178.673 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -90.23 -47.46 7.77 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.651 -0.704 . . . . 2.48 110.259 177.494 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' 0A1 . . . . . 0.478 ' HE1' HMC2 ' A' ' 27' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.498 ' HA ' ' HB3' ' A' ' 31' ' ' LEU . 76.9 mt-30 -64.42 -22.79 67.07 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.443 -0.344 . . . . 0.71999999999999997 111.858 -176.785 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 60.9 tttm -63.74 -59.01 5.11 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 121.122 0.486 . . . . 2.3599999999999999 110.233 176.444 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -68.79 -31.74 70.98 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.967 -0.56 . . . . 0.93999999999999995 110.396 178.889 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.498 ' HB3' ' HA ' ' A' ' 28' ' ' GLN . 31.5 tp -62.1 -33.95 75.41 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.842 -0.617 . . . . 1.3300000000000001 110.978 179.086 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.27 -30.45 71.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.206 -0.452 . . . . 1.0800000000000001 110.831 177.214 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -84.71 -33.48 23.14 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.108 -0.497 . . . . 1.46 110.192 177.93 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' 0A1 . . . . . 0.414 ' HE2' HMC2 ' A' ' 34' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.452 0 CA-C-N 116.521 -0.309 . . . . 1.1399999999999999 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 0' ' ' ACE . . . . . 0.542 ' H2 ' HMC2 ' A' ' 34' ' ' 0A1 . . . . . . . . 0 C--O 1.232 0.147 . . . . . . . . 1.1699999999999999 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -64.42 164.88 21.75 Favored 'Trans proline' 0 C--O 1.234 0.298 0 C-N-CA 122.592 2.195 . . . . 0.96999999999999997 112.21 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.457 ' HG2' ' CD2' ' A' ' 27' ' ' 0A1 . 29.5 Cg_endo -67.07 178.89 2.63 Favored 'Trans proline' 0 N--CA 1.462 -0.339 0 C-N-CA 122.482 2.121 . . . . 0.56000000000000005 111.752 174.271 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.7 p -74.16 113.32 11.22 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 116.152 -0.476 . . . . 0.69999999999999996 111.311 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.439 ' HA ' ' HD3' ' A' ' 5' ' ' PRO . 14.7 ptmt -91.83 138.33 24.97 Favored Pre-proline 0 C--N 1.322 -0.593 0 CA-C-N 116.032 -0.531 . . . . 1.96 110.204 178.719 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 4' ' ' LYS . 55.9 Cg_endo -83.88 169.35 11.85 Favored 'Trans proline' 0 N--CA 1.456 -0.696 0 C-N-CA 122.446 2.097 . . . . 0.44 112.994 -175.822 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 11.8 t -78.51 148.49 33.43 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.799 -0.637 . . . . 0.79000000000000004 110.64 -179.629 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp -79.94 129.24 71.19 Favored Pre-proline 0 C--N 1.323 -0.547 0 CA-C-N 116.151 -0.477 . . . . 1.6799999999999999 110.761 -179.419 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -80.91 101.72 1.31 Allowed 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 122.573 2.182 . . . . 0.72999999999999998 112.503 177.428 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -100.27 -70.69 0.93 Allowed Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.753 -0.737 . . . . 0.51000000000000001 112.148 178.397 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -98.49 -26.7 14.35 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.475 0.655 . . . . 2.4100000000000001 110.381 177.479 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 -89.37 21.01 3.51 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.412 -0.813 . . . . 2.4900000000000002 109.444 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -76.97 27.86 0.14 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.258 -0.883 . . . . 0.41999999999999998 112.667 -173.884 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 19.2 p -58.17 154.23 31.81 Favored Pre-proline 0 C--N 1.322 -0.628 0 CA-C-N 116.439 -0.346 . . . . 0.73999999999999999 110.319 177.474 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_exo -49.92 -32.93 31.93 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.624 2.216 . . . . 0.68000000000000005 112.079 -179.73 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -64.72 -50.48 66.77 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.64 -0.709 . . . . 2.4399999999999999 111.429 -179.194 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 75.3 tttt -85.34 -28.22 25.37 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.873 0.368 . . . . 1.8 110.867 -176.047 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.453 ' O ' ' HG3' ' A' ' 21' ' ' GLN . 57.3 tp -61.4 -46.92 88.15 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.115 -0.493 . . . . 0.35999999999999999 110.238 177.117 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.98 -31.95 72.02 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.153 -0.476 . . . . 0.27000000000000002 110.719 177.86 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -65.56 -41.72 92.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.264 0.554 . . . . 2.54 109.897 176.701 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' 0A1 . . . . . 0.525 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.453 ' HG3' ' O ' ' A' ' 17' ' ' LEU . 97.2 mt-30 -63.35 -41.46 98.86 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.9 -0.591 . . . . 1.99 111.131 178.747 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.03 -40.65 96.79 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.984 -0.553 . . . . 0.38 110.806 178.595 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -69.72 -32.07 70.44 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.254 -0.43 . . . . 0.56999999999999995 110.152 179.106 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' A' ' 20' ' ' 0A1 . 59.6 mt -61.31 -30.94 70.8 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 116.152 -0.476 . . . . 0.32000000000000001 110.794 175.729 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.44 -25.11 67.87 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.11 0.481 . . . . 0.37 110.723 178.938 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 46.2 mmtm -90.78 -49.13 6.62 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.648 -0.705 . . . . 2.48 109.833 177.108 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' 0A1 . . . . . 0.457 ' CD2' ' HG2' ' A' ' 2' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -64.07 -29.33 70.47 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.71 0.263 . . . . 0.71999999999999997 111.71 -176.667 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 61.6 tttp -63.69 -55.8 20.6 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-O 121.024 0.44 . . . . 2.3599999999999999 110.296 177.683 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -66.84 -31.99 72.96 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.846 -0.616 . . . . 0.93999999999999995 110.521 178.378 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 32.5 tp -62.53 -35.94 81.04 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.196 -0.456 . . . . 1.3300000000000001 110.516 178.646 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.51 -35.74 81.77 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.224 -0.444 . . . . 1.0800000000000001 110.103 174.925 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -69.85 -38.05 76.35 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.628 -0.715 . . . . 1.46 110.413 175.589 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' 0A1 . . . . . 0.542 HMC2 ' H2 ' ' A' ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.491 0 CA-C-N 116.352 -0.386 . . . . 1.1399999999999999 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.224 . . . . . . . . 1.1699999999999999 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 16.4 Cg_exo -65.47 156.58 62.74 Favored 'Trans proline' 0 N--CA 1.463 -0.288 0 C-N-CA 122.67 2.247 . . . . 0.96999999999999997 111.66 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.419 ' HB2' ' HD2' ' A' ' 27' ' ' 0A1 . 7.4 Cg_exo -70.41 176.25 7.53 Favored 'Trans proline' 0 C--O 1.235 0.338 0 C-N-CA 122.524 2.149 . . . . 0.56000000000000005 112.084 -179.919 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.2 p -70.21 101.66 1.92 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.151 -0.477 . . . . 0.69999999999999996 111.136 178.939 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 54.0 pttt -90.34 126.44 56.62 Favored Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 116.109 -0.496 . . . . 1.96 111.446 -176.892 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -75.92 159.24 38.18 Favored 'Trans proline' 0 N--CA 1.461 -0.428 0 C-N-CA 122.725 2.284 . . . . 0.44 112.207 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 9.0 t -72.22 140.65 48.8 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.159 -0.473 . . . . 0.79000000000000004 111.329 -177.198 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 34.6 mmtp -69.66 129.58 91.19 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 115.596 -0.729 . . . . 1.6799999999999999 110.661 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.506 ' HA ' ' OD1' ' A' ' 11' ' ' ASN . 58.0 Cg_endo -74.04 97.38 1.0 Allowed 'Trans proline' 0 C--O 1.235 0.363 0 C-N-CA 122.592 2.195 . . . . 0.72999999999999998 112.877 -179.615 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -101.26 -71.5 0.93 Allowed Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.93 -0.652 . . . . 0.51000000000000001 111.727 176.361 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -93.99 -20.51 19.91 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.942 0.877 . . . . 2.4100000000000001 109.196 174.878 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ASN . . . . . 0.517 ' O ' ' HB3' ' A' ' 16' ' ' LYS . 22.2 p-10 -94.73 21.32 7.55 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 114.439 -1.255 . . . . 2.4900000000000002 109.787 -178.542 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -78.54 19.05 0.5 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.879 -0.601 . . . . 0.41999999999999998 111.806 -177.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 19.3 p -60.85 149.89 78.95 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 116.099 -0.5 . . . . 0.73999999999999999 110.541 177.443 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -52.34 -29.06 37.25 Favored 'Trans proline' 0 C--N 1.343 0.274 0 C-N-CA 122.594 2.196 . . . . 0.68000000000000005 112.731 -179.535 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -65.35 -53.81 38.13 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.099 0.476 . . . . 2.4399999999999999 110.613 177.038 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.517 ' HB3' ' O ' ' A' ' 11' ' ' ASN . 42.8 tptt -81.15 -32.17 33.81 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.856 -0.611 . . . . 1.8 110.872 -174.533 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.437 ' O ' ' HG2' ' A' ' 21' ' ' GLN . 54.4 tp -62.28 -47.52 83.96 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.168 -0.469 . . . . 0.35999999999999999 111.086 -179.334 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.07 -31.55 72.83 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.973 0.416 . . . . 0.27000000000000002 110.192 177.837 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 57.9 tttm -69.3 -39.46 78.28 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.721 -0.672 . . . . 2.54 109.718 176.927 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' 0A1 . . . . . 0.476 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.437 ' HG2' ' O ' ' A' ' 17' ' ' LEU . 81.2 mm-40 -62.51 -44.63 95.88 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.013 -0.539 . . . . 1.99 110.895 177.986 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.92 -25.52 67.91 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.824 -0.625 . . . . 0.38 110.899 178.727 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -80.87 -37.31 30.05 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.425 -0.583 . . . . 0.56999999999999995 109.425 178.343 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.476 ' HG ' ' O ' ' A' ' 20' ' ' 0A1 . 67.8 mt -61.85 -31.18 71.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.794 -0.639 . . . . 0.32000000000000001 110.785 176.916 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.71 -30.85 70.21 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.307 0.575 . . . . 0.37 110.668 178.04 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 55.1 mttp -90.38 -46.02 8.64 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.463 -0.79 . . . . 2.48 110.062 178.773 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' 0A1 . . . . . 0.466 ' HE1' HMC2 ' A' ' 27' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.455 ' HA ' ' HB3' ' A' ' 31' ' ' LEU . 99.0 mt-30 -61.04 -30.08 70.1 Favored 'General case' 0 N--CA 1.463 0.217 0 O-C-N 123.029 0.206 . . . . 0.71999999999999997 111.55 -172.468 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 53.3 tttp -62.05 -53.37 56.54 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-O 121.137 0.494 . . . . 2.3599999999999999 110.07 177.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -70.34 -33.67 71.76 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.79 -0.641 . . . . 0.93999999999999995 110.568 178.006 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.455 ' HB3' ' HA ' ' A' ' 28' ' ' GLN . 2.9 tm? -64.34 -37.61 88.13 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.649 -0.705 . . . . 1.3300000000000001 110.541 -178.977 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.0 -28.96 69.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.025 0.44 . . . . 1.0800000000000001 110.715 175.621 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -74.47 -36.04 63.31 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.805 -0.634 . . . . 1.46 109.549 175.54 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.541 0 CA-C-N 116.421 -0.354 . . . . 1.1399999999999999 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.177 . . . . . . . . 1.1699999999999999 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.454 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . 23.0 Cg_exo -62.22 152.46 76.09 Favored 'Trans proline' 0 C--O 1.235 0.36 0 C-N-CA 122.448 2.099 . . . . 0.96999999999999997 111.721 . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.454 ' HD3' ' HA ' ' A' ' 1' ' ' PRO . 2.9 Cg_exo -72.53 172.45 15.08 Favored 'Trans proline' 0 N--CA 1.458 -0.562 0 C-N-CA 122.412 2.075 . . . . 0.56000000000000005 111.48 179.612 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 7.2 p -70.94 91.04 0.84 Allowed 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 120.942 0.401 . . . . 0.69999999999999996 111.424 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.445 ' HD3' ' H ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -57.98 126.27 76.56 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 116.009 -0.541 . . . . 1.96 110.263 174.316 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.429 ' HD3' ' HA ' ' A' ' 4' ' ' LYS . 10.5 Cg_exo -69.47 157.62 60.27 Favored 'Trans proline' 0 N--CA 1.463 -0.28 0 C-N-CA 122.508 2.139 . . . . 0.44 111.802 -179.251 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 5.6 t -64.81 138.24 58.26 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.078 0.466 . . . . 0.79000000000000004 109.835 176.232 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.468 ' HD3' ' N ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -79.99 129.9 68.63 Favored Pre-proline 0 C--N 1.318 -0.787 0 CA-C-N 115.949 -0.569 . . . . 1.6799999999999999 111.103 -175.318 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -71.11 88.6 0.69 Allowed 'Trans proline' 0 C--O 1.235 0.374 0 C-N-CA 122.81 2.34 . . . . 0.72999999999999998 112.992 179.207 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -101.58 -71.27 0.91 Allowed Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 121.011 -0.614 . . . . 0.51000000000000001 112.032 176.585 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -92.87 -25.46 18.07 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.631 0.729 . . . . 2.4100000000000001 110.3 179.185 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 18.2 m120 -97.62 22.19 9.32 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.07 -0.968 . . . . 2.4900000000000002 110.48 -179.867 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -73.65 31.47 0.07 Allowed 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 112.843 0.683 . . . . 0.41999999999999998 112.843 -174.502 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 47.9 p -66.1 148.52 98.37 Favored Pre-proline 0 C--N 1.316 -0.874 0 N-CA-C 109.987 -0.375 . . . . 0.73999999999999999 109.987 176.052 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -53.12 -30.2 49.03 Favored 'Trans proline' 0 C--N 1.342 0.225 0 C-N-CA 122.466 2.111 . . . . 0.68000000000000005 112.161 179.194 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -64.98 -51.08 63.71 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 116.209 -0.45 . . . . 2.4399999999999999 111.186 179.422 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 56.4 tttp -79.61 -33.78 41.22 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.17 -0.468 . . . . 1.8 110.512 -177.851 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.403 ' O ' ' HG3' ' A' ' 21' ' ' GLN . 56.8 tp -60.86 -38.99 87.47 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.843 -0.617 . . . . 0.35999999999999999 111.06 -179.493 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.18 -35.7 81.14 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.706 0.289 . . . . 0.27000000000000002 110.471 176.563 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -67.54 -37.55 82.88 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.167 -0.47 . . . . 2.54 109.889 177.333 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' 0A1 . . . . . 0.514 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.403 ' HG3' ' O ' ' A' ' 17' ' ' LEU . 50.5 mt-30 -61.47 -39.18 89.95 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.609 -0.723 . . . . 1.99 110.937 179.051 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.09 -31.39 66.02 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.568 -0.742 . . . . 0.38 111.233 179.308 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -78.53 -23.3 46.3 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.117 0.484 . . . . 0.56999999999999995 110.03 -179.121 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.514 ' HG ' ' O ' ' A' ' 20' ' ' 0A1 . 75.7 mt -61.99 -25.24 67.52 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.901 -0.59 . . . . 0.32000000000000001 110.192 173.134 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.481 ' O ' ' HE2' ' A' ' 29' ' ' LYS . . . -64.99 -19.61 66.08 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.04 0.448 . . . . 0.37 110.843 175.727 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 52.1 mttp -90.03 -55.34 3.66 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.221 -0.659 . . . . 2.48 109.221 173.571 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' 0A1 . . . . . 0.415 HMC2 ' HE1' ' A' ' 27' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 94.9 mt-30 -63.29 -36.38 83.5 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.759 0.314 . . . . 0.71999999999999997 111.054 -173.841 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.481 ' HE2' ' O ' ' A' ' 25' ' ' ALA . 22.4 ttmm -63.31 -53.11 57.86 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 116.18 -0.464 . . . . 2.3599999999999999 110.383 179.522 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -68.9 -27.88 66.18 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.854 -0.612 . . . . 0.93999999999999995 110.747 179.661 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 31.3 tp -61.61 -39.65 91.99 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.295 -0.411 . . . . 1.3300000000000001 110.748 179.435 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.32 -33.45 76.01 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.148 0.499 . . . . 1.0800000000000001 110.461 176.586 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -74.24 -35.36 63.83 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.624 -0.716 . . . . 1.46 110.339 177.738 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' 0A1 . . . . . 0.431 HMC2 ' HE2' ' A' ' 34' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.512 0 CA-C-N 116.455 -0.338 . . . . 1.1399999999999999 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.277 . . . . . . . . 1.1699999999999999 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.448 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . 25.7 Cg_exo -62.24 155.9 53.94 Favored 'Trans proline' 0 C--O 1.234 0.323 0 C-N-CA 122.67 2.247 . . . . 0.96999999999999997 111.907 . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' A' ' 1' ' ' PRO . 3.9 Cg_exo -74.23 -176.86 2.9 Favored 'Trans proline' 0 N--CA 1.461 -0.426 0 C-N-CA 122.7 2.267 . . . . 0.56000000000000005 111.681 177.583 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 12.8 p -72.65 87.79 1.25 Allowed 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.82 -0.627 . . . . 0.69999999999999996 111.271 179.525 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.492 ' HB3' HMC2 ' A' ' 27' ' ' 0A1 . 0.0 OUTLIER -61.16 123.85 77.68 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 115.949 -0.568 . . . . 1.96 110.826 177.064 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 4' ' ' LYS . 4.7 Cg_exo -76.13 156.0 37.95 Favored 'Trans proline' 0 N--CA 1.459 -0.524 0 C-N-CA 122.594 2.196 . . . . 0.44 111.837 177.371 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 8.1 t -74.67 135.94 41.89 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.275 0.559 . . . . 0.79000000000000004 110.521 179.637 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 45.8 mmtm -68.93 136.31 89.75 Favored Pre-proline 0 C--N 1.324 -0.527 0 CA-C-N 115.354 -0.839 . . . . 1.6799999999999999 110.96 -176.728 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -70.84 81.16 1.12 Allowed 'Trans proline' 0 N--CA 1.459 -0.526 0 C-N-CA 122.422 2.082 . . . . 0.72999999999999998 113.145 -179.34 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -100.57 -68.76 0.86 Allowed Glycine 0 N--CA 1.444 -0.806 0 N-CA-C 109.973 -1.251 . . . . 0.51000000000000001 109.973 170.532 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -89.42 -16.16 31.56 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 121.927 0.87 . . . . 2.4100000000000001 108.92 172.778 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ASN . . . . . 0.422 HD22 ' N ' ' A' ' 11' ' ' ASN . 0.9 OUTLIER -96.25 21.06 9.44 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 114.76 -1.109 . . . . 2.4900000000000002 110.128 179.156 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -84.61 14.78 4.27 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.094 -0.503 . . . . 0.41999999999999998 112.179 -174.453 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 12.8 p -63.28 146.99 95.67 Favored Pre-proline 0 C--N 1.325 -0.494 0 N-CA-C 109.672 -0.492 . . . . 0.73999999999999999 109.672 174.422 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -51.64 -31.51 40.88 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.306 2.004 . . . . 0.68000000000000005 112.245 -178.117 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 56.0 mm-40 -66.69 -60.1 3.0 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.94 -0.573 . . . . 2.4399999999999999 111.183 177.878 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.416 ' HB3' ' O ' ' A' ' 11' ' ' ASN . 21.2 tptm -72.95 -30.17 63.65 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.819 -0.628 . . . . 1.8 110.676 -173.904 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.426 ' O ' ' HG3' ' A' ' 21' ' ' GLN . 60.1 tp -61.24 -46.45 90.34 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.748 -0.66 . . . . 0.35999999999999999 110.727 177.348 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.26 -38.55 88.09 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.328 -0.396 . . . . 0.27000000000000002 110.318 178.191 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.499 ' C ' ' HD3' ' A' ' 19' ' ' LYS . 1.0 OUTLIER -60.99 -42.74 98.99 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.949 -0.569 . . . . 2.54 109.47 176.793 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 20' ' ' 0A1 . . . . . 0.486 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.426 ' HG3' ' O ' ' A' ' 17' ' ' LEU . 28.2 mt-30 -59.55 -43.37 93.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.181 0.515 . . . . 1.99 110.83 179.578 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -74.31 -29.61 61.7 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.438 -0.801 . . . . 0.38 111.468 -179.006 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -77.74 -24.19 49.13 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.038 0.447 . . . . 0.56999999999999995 110.178 -179.023 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.486 ' HG ' ' O ' ' A' ' 20' ' ' 0A1 . 60.6 mt -61.89 -31.15 71.41 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.913 -0.585 . . . . 0.32000000000000001 110.228 173.567 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.61 -22.22 66.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.044 0.45 . . . . 0.37 110.898 178.309 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 56.0 mttp -89.76 -49.68 6.5 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.798 -0.637 . . . . 2.48 109.703 176.993 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' 0A1 . . . . . 0.492 HMC2 ' HB3' ' A' ' 4' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -64.77 -25.24 67.84 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.139 -0.482 . . . . 0.71999999999999997 111.886 -174.772 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 55.7 tttp -65.14 -57.68 7.96 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-O 120.843 0.354 . . . . 2.3599999999999999 110.583 179.097 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.401 ' OD1' ' HG3' ' A' ' 2' ' ' PRO . 16.1 t70 -65.01 -34.8 79.31 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.144 -0.48 . . . . 0.93999999999999995 110.047 178.234 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 20.8 tp -63.14 -40.52 97.81 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.982 -0.554 . . . . 1.3300000000000001 110.862 179.862 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.82 -36.05 82.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.942 0.401 . . . . 1.0800000000000001 110.802 178.486 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -72.35 -39.39 68.15 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.938 -0.574 . . . . 1.46 109.768 177.777 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' 0A1 . . . . . 0.437 HMC3 ' HE2' ' A' ' 34' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.394 0 CA-C-N 116.645 -0.252 . . . . 1.1399999999999999 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.211 . . . . . . . . 1.1699999999999999 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.512 ' HD3' HMC3 ' A' ' 34' ' ' 0A1 . 18.9 Cg_exo -64.65 153.45 77.4 Favored 'Trans proline' 0 N--CA 1.46 -0.457 0 C-N-CA 122.498 2.132 . . . . 0.96999999999999997 111.685 . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.443 ' HD2' HD23 ' A' ' 31' ' ' LEU . 11.1 Cg_exo -69.78 167.94 23.03 Favored 'Trans proline' 0 C--O 1.235 0.362 0 C-N-CA 122.428 2.085 . . . . 0.56000000000000005 111.32 178.047 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.5 p -68.91 89.74 0.42 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.105 0.479 . . . . 0.69999999999999996 111.625 -178.534 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.43 ' HD3' ' H ' ' A' ' 4' ' ' LYS . 0.2 OUTLIER -58.62 131.86 85.69 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 115.543 -0.753 . . . . 1.96 111.091 176.914 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -67.02 151.29 82.19 Favored 'Trans proline' 0 C--O 1.235 0.369 0 C-N-CA 122.916 2.41 . . . . 0.44 112.687 -177.628 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 4.8 t -63.1 134.94 56.85 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.788 -0.642 . . . . 0.79000000000000004 111.021 178.346 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.462 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 72.7 mmtt -74.11 127.65 87.63 Favored Pre-proline 0 C--N 1.323 -0.565 0 CA-C-N 115.82 -0.627 . . . . 1.6799999999999999 110.301 -179.401 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.462 ' HD3' ' HA ' ' A' ' 7' ' ' LYS . 4.2 Cg_exo -78.59 102.93 1.6 Allowed 'Trans proline' 0 N--CA 1.456 -0.686 0 C-N-CA 122.708 2.272 . . . . 0.72999999999999998 112.228 179.074 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -100.69 -70.29 0.9 Allowed Glycine 0 N--CA 1.444 -0.778 0 CA-C-N 115.807 -0.633 . . . . 0.51000000000000001 111.586 175.152 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -87.62 -29.95 20.82 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.424 0.63 . . . . 2.4100000000000001 110.536 178.814 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 19.4 m120 -92.24 21.74 4.96 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.316 -0.856 . . . . 2.4900000000000002 109.789 -179.545 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -74.65 28.72 0.09 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.413 -0.812 . . . . 0.41999999999999998 112.774 -174.645 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 32.9 p -70.37 152.54 95.51 Favored Pre-proline 0 C--N 1.316 -0.873 0 N-CA-C 109.65 -0.5 . . . . 0.73999999999999999 109.65 176.275 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -52.33 -24.74 22.09 Favored 'Trans proline' 0 C--N 1.343 0.272 0 C-N-CA 122.751 2.3 . . . . 0.68000000000000005 112.601 178.915 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -62.7 -50.72 70.03 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 116.114 -0.494 . . . . 2.4399999999999999 110.795 177.633 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 52.6 tttp -89.89 -33.72 16.34 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.164 -0.471 . . . . 1.8 110.687 -177.137 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.606 ' O ' ' HG2' ' A' ' 21' ' ' GLN . 54.1 tp -60.79 -44.63 96.56 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.943 -0.571 . . . . 0.35999999999999999 111.012 -178.33 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.46 -33.0 74.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.606 0.241 . . . . 0.27000000000000002 110.85 179.268 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -72.98 -34.4 66.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.234 0.54 . . . . 2.54 109.685 178.194 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' 0A1 . . . . . 0.441 ' HE1' HMC2 ' A' ' 20' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.606 ' HG2' ' O ' ' A' ' 17' ' ' LEU . 87.8 mm-40 -62.98 -40.53 98.03 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.787 -0.642 . . . . 1.99 110.911 177.695 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.13 -37.51 83.96 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.933 -0.576 . . . . 0.38 110.925 179.27 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -69.4 -35.46 75.79 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.088 -0.505 . . . . 0.56999999999999995 110.095 178.729 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.431 ' HG ' ' O ' ' A' ' 20' ' ' 0A1 . 54.3 mt -61.84 -31.63 71.9 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.026 -0.534 . . . . 0.32000000000000001 110.833 176.154 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.87 -30.9 71.17 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.235 0.54 . . . . 0.37 110.673 179.128 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 65.8 mttm -90.84 -43.47 10.02 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.368 -0.833 . . . . 2.48 110.594 178.074 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' 0A1 . . . . . 0.428 ' HE1' HMC2 ' A' ' 27' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 95.1 mt-30 -61.66 -27.02 68.38 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.845 0.355 . . . . 0.71999999999999997 110.848 -174.393 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -61.95 -60.14 4.07 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 115.913 -0.585 . . . . 2.3599999999999999 110.283 178.418 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -68.87 -33.76 74.32 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.844 -0.616 . . . . 0.93999999999999995 110.902 178.935 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.443 HD23 ' HD2' ' A' ' 2' ' ' PRO . 3.3 tm? -61.53 -42.42 98.78 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.858 -0.61 . . . . 1.3300000000000001 110.127 179.849 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -62.44 -42.09 99.2 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.198 -0.456 . . . . 1.0800000000000001 110.539 177.101 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -63.96 -42.48 97.27 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.731 -0.668 . . . . 1.46 110.826 179.29 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' 0A1 . . . . . 0.512 HMC3 ' HD3' ' A' ' 1' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.553 0 CA-C-N 116.342 -0.39 . . . . 1.1399999999999999 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.262 . . . . . . . . 1.1699999999999999 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.432 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . 26.8 Cg_exo -62.29 150.79 85.78 Favored 'Trans proline' 0 CA--C 1.531 0.331 0 C-N-CA 122.384 2.056 . . . . 0.96999999999999997 111.825 . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.432 ' HD3' ' HA ' ' A' ' 1' ' ' PRO . 3.1 Cg_exo -78.67 176.84 9.42 Favored 'Trans proline' 0 N--CA 1.46 -0.471 0 C-N-CA 122.802 2.334 . . . . 0.56000000000000005 111.947 -178.982 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 9.3 p -66.31 100.36 0.62 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.087 -0.506 . . . . 0.69999999999999996 110.998 179.524 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.437 ' HA ' ' HD3' ' A' ' 5' ' ' PRO . 23.8 pttm -80.48 127.74 74.85 Favored Pre-proline 0 C--O 1.236 0.365 0 CA-C-N 116.335 -0.393 . . . . 1.96 110.577 -179.438 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.468 ' HB2' ' HD2' ' A' ' 20' ' ' 0A1 . 4.1 Cg_exo -75.39 158.0 40.87 Favored 'Trans proline' 0 N--CA 1.46 -0.465 0 C-N-CA 122.675 2.25 . . . . 0.44 112.6 -175.858 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.8 t -67.03 140.88 57.69 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.695 -0.684 . . . . 0.79000000000000004 110.479 178.451 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.459 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 45.5 mmtm -80.12 128.55 73.08 Favored Pre-proline 0 C--N 1.319 -0.74 0 CA-C-N 115.943 -0.571 . . . . 1.6799999999999999 110.51 -178.035 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.459 ' HD3' ' HA ' ' A' ' 7' ' ' LYS . 1.9 Cg_endo -81.32 94.99 0.94 Allowed 'Trans proline' 0 N--CA 1.452 -0.946 0 C-N-CA 122.367 2.045 . . . . 0.72999999999999998 112.132 178.771 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -98.08 -69.1 0.94 Allowed Glycine 0 N--CA 1.446 -0.692 0 N-CA-C 111.071 -0.812 . . . . 0.51000000000000001 111.071 176.758 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -93.64 -20.51 20.12 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 121.717 0.77 . . . . 2.4100000000000001 109.536 173.37 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ASN . . . . . 0.413 ' C ' ' H ' ' A' ' 13' ' ' THR . 16.2 m120 -92.69 21.38 5.55 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.043 -0.98 . . . . 2.4900000000000002 109.897 179.691 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -75.79 24.34 0.12 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.6 -0.727 . . . . 0.41999999999999998 112.088 -176.305 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.413 ' H ' ' C ' ' A' ' 11' ' ' ASN . 13.2 p -61.51 149.26 84.44 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 116.057 -0.52 . . . . 0.73999999999999999 110.454 175.711 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -49.27 -35.79 35.61 Favored 'Trans proline' 0 C--N 1.343 0.248 0 C-N-CA 122.921 2.414 . . . . 0.68000000000000005 112.405 -179.474 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 23.7 mm-40 -63.78 -54.15 39.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.988 -0.551 . . . . 2.4399999999999999 111.63 -179.905 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 52.2 tptt -74.48 -34.72 63.19 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.208 0.528 . . . . 1.8 110.162 -176.57 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.508 ' O ' ' HG2' ' A' ' 21' ' ' GLN . 55.9 tp -61.91 -40.89 97.0 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.46 -0.791 . . . . 0.35999999999999999 110.721 179.64 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.17 -40.97 95.01 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.765 0.317 . . . . 0.27000000000000002 110.594 178.522 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 27.9 tptp -64.37 -38.49 91.23 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.135 -0.484 . . . . 2.54 110.042 177.556 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' 0A1 . . . . . 0.537 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.508 ' HG2' ' O ' ' A' ' 17' ' ' LEU . 78.7 mm-40 -60.87 -45.35 94.91 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.999 -0.546 . . . . 1.99 110.965 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.31 -27.82 65.72 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.821 -0.627 . . . . 0.38 111.611 -177.622 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.425 ' HA ' ' HD3' ' A' ' 26' ' ' LYS . 4.8 t70 -82.83 -26.61 31.53 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.138 0.494 . . . . 0.56999999999999995 109.978 -178.54 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.537 ' HG ' ' O ' ' A' ' 20' ' ' 0A1 . 73.0 mt -62.83 -28.37 69.96 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.873 -0.603 . . . . 0.32000000000000001 110.684 175.087 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.14 -26.09 68.12 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.496 0.665 . . . . 0.37 110.455 177.843 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.425 ' HD3' ' HA ' ' A' ' 23' ' ' ASP . 39.3 mtpt -87.38 -53.65 4.71 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.143 -0.935 . . . . 2.48 109.835 176.962 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' 0A1 . . . . . 0.427 ' CE2' ' HB3' ' A' ' 4' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -62.18 -25.19 67.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.566 -0.288 . . . . 0.71999999999999997 111.697 -172.168 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 61.4 tttp -63.39 -65.57 0.66 Allowed 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 116.373 -0.376 . . . . 2.3599999999999999 110.63 179.161 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.408 ' OD1' ' HG3' ' A' ' 2' ' ' PRO . 27.9 t70 -67.04 -30.74 70.9 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.318 -0.401 . . . . 0.93999999999999995 110.634 179.84 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -61.4 -46.62 89.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.213 -0.449 . . . . 1.3300000000000001 110.475 -179.637 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.29 -34.66 78.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.229 -0.441 . . . . 1.0800000000000001 111.12 179.035 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -72.89 -39.19 66.6 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.031 0.443 . . . . 1.46 110.627 179.457 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' 0A1 . . . . . 0.411 HMC2 ' HE2' ' A' ' 34' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.458 0 CA-C-N 116.377 -0.374 . . . . 1.1399999999999999 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.155 . . . . . . . . 1.1699999999999999 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -62.34 163.52 20.26 Favored 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 122.536 2.158 . . . . 0.96999999999999997 111.767 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 14.9 Cg_exo -68.03 177.91 3.96 Favored 'Trans proline' 0 C--O 1.234 0.277 0 C-N-CA 122.29 1.994 . . . . 0.56000000000000005 110.765 173.152 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 7.7 p -57.13 104.64 0.17 Allowed 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 110.232 -0.285 . . . . 0.69999999999999996 110.232 175.612 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.428 ' HA ' ' HD3' ' A' ' 5' ' ' PRO . 46.8 pttt -88.79 135.71 31.77 Favored Pre-proline 0 C--N 1.322 -0.627 0 CA-C-O 120.963 0.411 . . . . 1.96 111.153 -174.328 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 4' ' ' LYS . 31.7 Cg_endo -78.97 141.23 16.55 Favored 'Trans proline' 0 N--CA 1.452 -0.959 0 C-N-CA 122.47 2.113 . . . . 0.44 111.341 -179.578 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 9.0 t -62.76 139.82 58.71 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.085 0.469 . . . . 0.79000000000000004 110.704 -177.882 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 34.6 mmtp -73.18 129.76 85.65 Favored Pre-proline 0 C--N 1.324 -0.532 0 CA-C-N 115.497 -0.774 . . . . 1.6799999999999999 110.358 -177.421 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -75.46 92.21 1.02 Allowed 'Trans proline' 0 N--CA 1.457 -0.622 0 C-N-CA 122.503 2.135 . . . . 0.72999999999999998 112.359 -179.78 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -98.43 -70.44 0.98 Allowed Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 120.819 -0.705 . . . . 0.51000000000000001 111.432 177.142 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -93.41 -24.15 18.16 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-O 121.545 0.688 . . . . 2.4100000000000001 110.22 176.29 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 82.7 m-20 -93.17 22.16 5.32 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.277 -0.874 . . . . 2.4900000000000002 110.092 -178.48 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -75.99 23.82 0.13 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.731 -0.668 . . . . 0.41999999999999998 112.536 -175.222 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 15.5 p -64.41 148.93 95.73 Favored Pre-proline 0 C--N 1.321 -0.641 0 CA-C-N 116.437 -0.347 . . . . 0.73999999999999999 110.305 177.968 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -51.84 -31.69 43.53 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.677 2.251 . . . . 0.68000000000000005 112.344 -179.836 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -62.4 -45.1 94.64 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.609 -0.723 . . . . 2.4399999999999999 111.096 179.631 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 48.1 tttp -90.8 -34.32 15.36 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.413 -0.358 . . . . 1.8 111.24 -176.725 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.459 ' O ' ' HG2' ' A' ' 21' ' ' GLN . 54.8 tp -59.77 -39.35 84.57 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.259 -0.428 . . . . 0.35999999999999999 111.034 -176.552 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.89 -37.17 85.4 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.743 0.306 . . . . 0.27000000000000002 110.648 177.81 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 27.9 tptp -65.38 -41.14 94.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.205 -0.452 . . . . 2.54 109.919 176.48 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' 0A1 . . . . . 0.482 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.459 ' HG2' ' O ' ' A' ' 17' ' ' LEU . 83.7 mm-40 -62.05 -46.71 87.92 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.128 -0.487 . . . . 1.99 111.016 179.135 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.1 -33.71 76.67 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.929 -0.578 . . . . 0.38 111.234 -179.785 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -74.44 -29.27 61.42 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.14 -0.482 . . . . 0.56999999999999995 110.254 179.688 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.482 ' HG ' ' O ' ' A' ' 20' ' ' 0A1 . 68.4 mt -63.96 -31.23 72.35 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.263 -0.426 . . . . 0.32000000000000001 110.762 176.062 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.52 -26.73 68.71 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.523 0.678 . . . . 0.37 110.159 176.831 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 59.1 mttm -87.82 -46.69 9.22 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.061 -0.972 . . . . 2.48 109.67 177.189 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 93.9 mt-30 -63.42 -32.44 73.88 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.503 -0.317 . . . . 0.71999999999999997 111.372 -174.849 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 56.2 tptt -65.64 -53.94 34.43 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-O 120.916 0.389 . . . . 2.3599999999999999 110.419 177.29 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -65.23 -30.75 71.66 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.318 0.58 . . . . 0.93999999999999995 110.291 179.371 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 23.1 tp -62.57 -34.24 76.57 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.498 -0.774 . . . . 1.3300000000000001 110.799 178.519 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.81 -30.75 71.76 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.085 -0.507 . . . . 1.0800000000000001 111.083 178.606 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -72.95 -26.78 61.5 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.094 0.473 . . . . 1.46 110.298 178.148 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.497 0 CA-C-N 116.451 -0.341 . . . . 1.1399999999999999 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.23 . . . . . . . . 1.1699999999999999 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -63.12 155.32 61.86 Favored 'Trans proline' 0 C--O 1.236 0.403 0 C-N-CA 122.411 2.074 . . . . 0.96999999999999997 112.54 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.536 ' HG2' ' CD2' ' A' ' 27' ' ' 0A1 . 37.9 Cg_endo -68.41 175.26 7.12 Favored 'Trans proline' 0 C--O 1.233 0.229 0 C-N-CA 123.1 2.534 . . . . 0.56000000000000005 112.641 -179.5 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 6.5 p -63.74 108.92 1.55 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.909 -0.587 . . . . 0.69999999999999996 111.386 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.455 ' HA ' ' HD3' ' A' ' 5' ' ' PRO . 57.2 pttt -93.58 142.81 25.64 Favored Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 116.476 -0.329 . . . . 1.96 110.814 -179.605 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.455 ' HD3' ' HA ' ' A' ' 4' ' ' LYS . 22.2 Cg_endo -84.52 179.28 4.53 Favored 'Trans proline' 0 N--CA 1.457 -0.674 0 C-N-CA 122.669 2.246 . . . . 0.44 112.683 -176.474 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 9.8 t -93.92 149.83 20.89 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.336 -0.393 . . . . 0.79000000000000004 110.072 177.458 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.478 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 68.4 mmtt -82.25 130.27 60.32 Favored Pre-proline 0 C--N 1.326 -0.425 0 CA-C-O 120.624 0.25 . . . . 1.6799999999999999 110.732 -177.474 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.478 ' HD3' ' HA ' ' A' ' 7' ' ' LYS . 7.2 Cg_exo -72.14 105.75 1.9 Allowed 'Trans proline' 0 C--O 1.235 0.352 0 C-N-CA 122.765 2.31 . . . . 0.72999999999999998 112.602 178.124 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -95.78 -70.98 1.08 Allowed Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.903 -0.665 . . . . 0.51000000000000001 111.623 176.736 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -95.37 -18.19 20.96 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.775 0.798 . . . . 2.4100000000000001 109.649 176.139 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 18.3 m120 -93.33 21.0 6.45 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.028 -0.987 . . . . 2.4900000000000002 109.67 178.879 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -78.09 16.08 0.81 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.479 -0.782 . . . . 0.41999999999999998 111.982 -174.554 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 23.8 p -68.25 153.31 95.69 Favored Pre-proline 0 C--N 1.322 -0.599 0 CA-C-N 116.171 -0.468 . . . . 0.73999999999999999 110.045 174.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_exo -51.29 -22.34 11.4 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 123.023 2.482 . . . . 0.68000000000000005 113.02 -179.351 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -62.63 -62.91 1.42 Allowed 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 116.302 -0.408 . . . . 2.4399999999999999 111.425 178.961 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -82.96 -27.66 30.35 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.923 0.392 . . . . 1.8 110.691 -177.269 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.536 ' O ' ' HG2' ' A' ' 21' ' ' GLN . 55.7 tp -60.12 -40.65 90.5 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.984 -0.553 . . . . 0.35999999999999999 110.829 179.457 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.8 -36.42 80.4 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.77 0.319 . . . . 0.27000000000000002 110.634 177.148 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -64.48 -40.48 95.75 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.633 -0.506 . . . . 2.54 109.633 176.624 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' 0A1 . . . . . 0.466 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.536 ' HG2' ' O ' ' A' ' 17' ' ' LEU . 85.7 mm-40 -62.66 -43.51 98.62 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.115 -0.493 . . . . 1.99 110.698 177.296 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.95 -36.77 84.55 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.734 -0.666 . . . . 0.38 111.01 178.016 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -68.88 -37.59 79.12 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.726 -0.472 . . . . 0.56999999999999995 109.726 178.673 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 20' ' ' 0A1 . 79.1 mt -63.02 -28.32 70.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.697 -0.683 . . . . 0.32000000000000001 110.979 177.009 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.98 -26.98 69.1 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.226 0.536 . . . . 0.37 110.564 177.258 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 51.8 mtmt -89.27 -51.17 5.71 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.586 -0.733 . . . . 2.48 109.861 176.432 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' 0A1 . . . . . 0.536 ' CD2' ' HG2' ' A' ' 2' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.41 ' HA ' ' HB3' ' A' ' 31' ' ' LEU . 96.7 mt-30 -64.17 -23.83 67.46 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.668 -0.242 . . . . 0.71999999999999997 111.634 -173.202 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 60.6 tttp -63.84 -57.37 10.08 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 121.185 0.517 . . . . 2.3599999999999999 110.06 177.754 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.426 ' HB3' ' HG3' ' A' ' 2' ' ' PRO . 14.1 t70 -67.75 -36.78 81.15 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.489 -0.778 . . . . 0.93999999999999995 110.466 178.522 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.41 ' HB3' ' HA ' ' A' ' 28' ' ' GLN . 3.1 tm? -64.28 -38.39 90.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.399 -0.819 . . . . 1.3300000000000001 110.822 -177.989 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.0 -30.5 71.49 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.146 0.498 . . . . 1.0800000000000001 110.947 178.393 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -79.26 -37.55 37.65 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.878 -0.601 . . . . 1.46 110.421 178.14 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' 0A1 . . . . . 0.428 ' HE1' HMC3 ' A' ' 34' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.374 0 CA-C-N 116.273 -0.422 . . . . 1.1399999999999999 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.203 . . . . . . . . 1.1699999999999999 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.449 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . 16.9 Cg_exo -65.44 155.23 69.87 Favored 'Trans proline' 0 N--CA 1.461 -0.416 0 C-N-CA 122.497 2.131 . . . . 0.96999999999999997 111.595 . . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.449 ' HD3' ' HA ' ' A' ' 1' ' ' PRO . 4.6 Cg_exo -72.16 179.51 4.89 Favored 'Trans proline' 0 N--CA 1.46 -0.486 0 C-N-CA 122.533 2.155 . . . . 0.56000000000000005 110.952 176.243 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 11.7 p -62.87 94.7 0.07 Allowed 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.955 0.407 . . . . 0.69999999999999996 110.466 176.458 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.496 ' HA ' ' HD3' ' A' ' 5' ' ' PRO . 6.6 ptmm? -75.33 125.82 88.46 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-N 115.929 -0.578 . . . . 1.96 110.977 -175.617 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.496 ' HD3' ' HA ' ' A' ' 4' ' ' LYS . 2.5 Cg_endo -81.1 166.43 18.64 Favored 'Trans proline' 0 N--CA 1.454 -0.803 0 C-N-CA 122.628 2.219 . . . . 0.44 112.12 -178.064 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.1 t -78.89 138.54 38.17 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.026 -0.534 . . . . 0.79000000000000004 110.565 179.672 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 48.6 mmtm -74.81 128.71 84.84 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-N 115.818 -0.628 . . . . 1.6799999999999999 110.028 177.811 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.412 ' HA ' ' OD1' ' A' ' 11' ' ' ASN . 58.7 Cg_endo -75.3 84.72 1.66 Allowed 'Trans proline' 0 N--CA 1.46 -0.477 0 C-N-CA 122.642 2.228 . . . . 0.72999999999999998 113.201 -176.886 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -101.77 -71.81 0.93 Allowed Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.879 -0.676 . . . . 0.51000000000000001 111.819 174.419 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -94.05 6.44 48.53 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.341 0.591 . . . . 2.4100000000000001 109.809 177.319 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ASN . . . . . 0.439 ' HB2' ' HD2' ' A' ' 16' ' ' LYS . 10.2 p30 -126.55 20.51 7.25 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.227 -0.897 . . . . 2.4900000000000002 109.719 -179.503 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -79.43 29.62 0.24 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.129 -0.941 . . . . 0.41999999999999998 113.009 -170.493 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 6.8 p -64.43 143.64 98.52 Favored Pre-proline 0 C--N 1.316 -0.859 0 N-CA-C 109.897 -0.408 . . . . 0.73999999999999999 109.897 175.445 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -50.24 -32.96 34.57 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.834 2.356 . . . . 0.68000000000000005 112.304 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 51.7 mm-40 -63.09 -48.04 80.29 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.739 -0.664 . . . . 2.4399999999999999 111.208 179.209 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.439 ' HD2' ' HB2' ' A' ' 11' ' ' ASN . 3.8 ttmp? -84.03 -32.12 25.05 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.369 -0.378 . . . . 1.8 110.51 -177.526 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.511 ' O ' ' HG3' ' A' ' 21' ' ' GLN . 57.5 tp -59.61 -46.22 89.63 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.983 -0.553 . . . . 0.35999999999999999 110.799 179.258 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.34 -36.84 85.43 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.428 -0.351 . . . . 0.27000000000000002 110.626 177.732 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 57.6 tptt -65.07 -41.27 95.24 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.163 -0.472 . . . . 2.54 110.146 177.04 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' 0A1 . . . . . 0.598 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.511 ' HG3' ' O ' ' A' ' 17' ' ' LEU . 97.5 mt-30 -62.06 -41.02 97.7 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.717 -0.674 . . . . 1.99 110.899 179.467 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.52 -34.9 72.81 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.897 -0.592 . . . . 0.38 110.983 178.969 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -70.81 -29.88 66.17 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.767 -0.457 . . . . 0.56999999999999995 109.767 179.568 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.598 ' HG ' ' O ' ' A' ' 20' ' ' 0A1 . 71.3 mt -61.36 -28.82 69.5 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.877 -0.601 . . . . 0.32000000000000001 110.593 176.02 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.47 -29.24 70.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.332 0.586 . . . . 0.37 110.572 177.818 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 64.5 mttm -91.24 -47.57 7.43 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.226 -0.897 . . . . 2.48 110.21 177.46 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' 0A1 . . . . . 0.452 HMC2 ' HE2' ' A' ' 27' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.448 ' HA ' ' HB3' ' A' ' 31' ' ' LEU . 97.8 mt-30 -65.38 -21.44 66.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.529 -0.305 . . . . 0.71999999999999997 111.509 -174.757 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -64.76 -57.98 7.48 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-O 121.009 0.433 . . . . 2.3599999999999999 110.078 176.565 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -66.42 -33.31 75.43 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.256 0.55 . . . . 0.93999999999999995 110.093 178.304 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.448 ' HB3' ' HA ' ' A' ' 28' ' ' GLN . 18.6 tp -62.29 -36.27 81.59 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.612 -0.722 . . . . 1.3300000000000001 110.971 179.355 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.93 -36.1 80.39 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.282 -0.417 . . . . 1.0800000000000001 111.009 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -78.04 -33.58 50.95 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.0 0.429 . . . . 1.46 110.145 177.148 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.475 0 CA-C-N 116.59 -0.277 . . . . 1.1399999999999999 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.195 . . . . . . . . 1.1699999999999999 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -65.07 168.07 14.73 Favored 'Trans proline' 0 C--O 1.237 0.45 0 C-N-CA 123.019 2.479 . . . . 0.96999999999999997 112.191 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.411 ' HG2' ' CD2' ' A' ' 27' ' ' 0A1 . 60.9 Cg_endo -78.5 -179.46 5.47 Favored 'Trans proline' 0 C--O 1.235 0.335 0 C-N-CA 122.626 2.218 . . . . 0.56000000000000005 112.251 178.464 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 4.5 p -63.04 97.77 0.12 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.83 -0.623 . . . . 0.69999999999999996 111.999 -178.89 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.421 ' HD3' ' H ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -73.36 128.8 86.82 Favored Pre-proline 0 N--CA 1.448 -0.542 0 CA-C-N 116.137 -0.483 . . . . 1.96 110.192 176.715 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -71.35 158.0 55.4 Favored 'Trans proline' 0 C--O 1.237 0.471 0 C-N-CA 122.542 2.162 . . . . 0.44 112.258 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 10.2 t -64.55 139.89 58.81 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.904 -0.589 . . . . 0.79000000000000004 110.161 178.686 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 43.2 mmtm -81.55 129.41 65.88 Favored Pre-proline 0 C--N 1.321 -0.633 0 CA-C-N 116.093 -0.503 . . . . 1.6799999999999999 110.898 -175.756 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_endo -77.65 89.97 1.29 Allowed 'Trans proline' 0 N--CA 1.457 -0.65 0 C-N-CA 122.816 2.344 . . . . 0.72999999999999998 112.691 179.796 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -101.45 -70.71 0.89 Allowed Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.831 -0.7 . . . . 0.51000000000000001 111.374 174.5 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -88.96 -25.29 22.13 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 121.525 0.679 . . . . 2.4100000000000001 110.021 176.366 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -96.31 21.56 8.88 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.217 -0.901 . . . . 2.4900000000000002 109.322 -179.999 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -74.29 13.96 0.5 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.49 -0.777 . . . . 0.41999999999999998 112.125 -177.009 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 17.4 p -57.75 151.25 43.26 Favored Pre-proline 0 C--N 1.323 -0.557 0 CA-C-N 116.156 -0.475 . . . . 0.73999999999999999 110.394 175.43 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -58.36 -18.19 37.08 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.71 2.273 . . . . 0.68000000000000005 112.17 -176.605 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -63.14 -57.24 11.24 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.652 -0.704 . . . . 2.4399999999999999 110.204 177.463 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 66.0 tttt -91.13 -23.32 20.32 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.524 -0.762 . . . . 1.8 111.115 -174.625 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.457 ' O ' ' HG3' ' A' ' 21' ' ' GLN . 54.9 tp -59.8 -41.98 92.44 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.268 -0.424 . . . . 0.35999999999999999 110.79 179.833 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.45 -35.67 75.88 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.927 0.394 . . . . 0.27000000000000002 110.63 177.46 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -67.19 -37.49 83.77 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.217 -0.447 . . . . 2.54 109.916 178.707 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' 0A1 . . . . . 0.514 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.457 ' HG3' ' O ' ' A' ' 17' ' ' LEU . 78.2 mt-30 -60.77 -45.12 95.56 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.853 -0.612 . . . . 1.99 110.586 177.013 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.61 -31.02 72.06 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.534 -0.757 . . . . 0.38 111.298 179.865 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -77.13 -33.15 56.82 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.928 0.394 . . . . 0.56999999999999995 109.943 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.514 ' HG ' ' O ' ' A' ' 20' ' ' 0A1 . 71.2 mt -60.61 -29.49 69.25 Favored 'General case' 0 C--O 1.225 -0.211 0 CA-C-N 115.963 -0.562 . . . . 0.32000000000000001 110.639 176.913 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.66 -26.4 68.63 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.185 0.517 . . . . 0.37 110.799 178.138 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt -91.28 -48.55 6.85 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.65 -0.705 . . . . 2.48 110.251 176.255 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' 0A1 . . . . . 0.419 HMC2 ' HE1' ' A' ' 27' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -64.42 -31.36 72.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.512 -0.313 . . . . 0.71999999999999997 110.926 -176.906 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 19.0 ttmm -61.06 -54.64 42.24 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-O 121.258 0.551 . . . . 2.3599999999999999 110.286 178.88 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -68.14 -36.98 80.57 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.489 -0.778 . . . . 0.93999999999999995 110.377 179.093 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 19.1 tp -62.77 -37.99 88.83 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.918 -0.583 . . . . 1.3300000000000001 110.92 -179.342 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.99 -36.68 85.17 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.056 0.455 . . . . 1.0800000000000001 110.758 176.27 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -71.9 -37.28 70.14 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.818 -0.628 . . . . 1.46 110.334 177.65 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' 0A1 . . . . . 0.427 HMC2 ' HE1' ' A' ' 34' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.555 0 CA-C-N 116.349 -0.387 . . . . 1.1399999999999999 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.256 . . . . . . . . 1.1699999999999999 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -62.49 155.33 58.69 Favored 'Trans proline' 0 C--O 1.237 0.444 0 C-N-CA 122.68 2.253 . . . . 0.96999999999999997 112.542 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.485 ' HG2' ' CD2' ' A' ' 27' ' ' 0A1 . 35.6 Cg_endo -67.71 176.9 4.59 Favored 'Trans proline' 0 C--O 1.235 0.355 0 C-N-CA 122.967 2.445 . . . . 0.56000000000000005 112.718 -179.501 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 39.8 p -66.79 103.01 1.02 Allowed 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.892 -0.595 . . . . 0.69999999999999996 111.129 -179.033 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.487 ' HA ' ' HD3' ' A' ' 5' ' ' PRO . 58.7 pttt -83.48 135.06 44.11 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 116.377 -0.374 . . . . 1.96 110.9 -178.72 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.487 ' HD3' ' HA ' ' A' ' 4' ' ' LYS . 10.0 Cg_exo -71.03 148.28 56.53 Favored 'Trans proline' 0 N--CA 1.46 -0.488 0 C-N-CA 122.508 2.139 . . . . 0.44 112.39 -179.431 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 5.1 t -69.87 136.5 50.75 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.913 -0.585 . . . . 0.79000000000000004 109.799 176.953 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 44.5 mmtm -69.54 149.7 96.99 Favored Pre-proline 0 C--N 1.324 -0.517 0 CA-C-N 115.596 -0.729 . . . . 1.6799999999999999 112.058 -170.099 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -61.58 65.7 0.1 Allowed 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 123.523 2.815 . . . . 0.72999999999999998 114.053 174.024 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -92.94 -69.83 1.13 Allowed Glycine 0 C--N 1.31 -0.892 0 N-CA-C 109.415 -1.474 . . . . 0.51000000000000001 109.415 166.629 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -97.68 2.1 49.34 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 108.75 -0.833 . . . . 2.4100000000000001 108.75 168.5 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 52.1 m-80 -104.9 19.48 20.48 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.141 -0.936 . . . . 2.4900000000000002 110.005 -179.542 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -95.42 6.37 49.17 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.327 -0.397 . . . . 0.41999999999999998 111.266 -175.662 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 11.8 p -64.3 145.59 98.17 Favored Pre-proline 0 C--N 1.325 -0.487 0 N-CA-C 109.458 -0.571 . . . . 0.73999999999999999 109.458 172.058 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_exo -49.07 -37.17 37.44 Favored 'Trans proline' 0 C--O 1.233 0.244 0 C-N-CA 122.339 2.026 . . . . 0.68000000000000005 112.309 -178.551 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 24.3 mm-40 -68.21 -48.86 64.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.771 -0.649 . . . . 2.4399999999999999 111.56 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 22.1 tptp -82.85 -26.71 31.39 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.057 -0.52 . . . . 1.8 110.81 -174.159 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 48.1 tp -64.15 -41.6 97.11 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.03 -0.532 . . . . 0.35999999999999999 110.269 177.524 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.99 -38.22 87.94 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.886 -0.597 . . . . 0.27000000000000002 110.006 175.803 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 56.2 tptt -65.48 -38.98 91.37 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.723 -0.672 . . . . 2.54 110.38 176.918 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 74.5 mm-40 -63.01 -46.58 86.93 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.148 -0.478 . . . . 1.99 111.251 178.218 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.49 -38.16 88.81 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.596 -0.729 . . . . 0.38 111.25 179.429 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 28.2 t0 -73.91 -29.44 62.05 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.122 0.487 . . . . 0.56999999999999995 110.158 -179.672 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 30.4 mt -62.62 -32.82 73.92 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 115.99 -0.55 . . . . 0.32000000000000001 110.676 173.795 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.88 -34.09 74.09 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.141 0.496 . . . . 0.37 110.509 -179.719 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -79.33 -46.02 18.49 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.483 -0.78 . . . . 2.48 110.211 177.535 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' 0A1 . . . . . 0.485 ' CD2' ' HG2' ' A' ' 2' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.449 ' HA ' ' HB3' ' A' ' 31' ' ' LEU . 96.7 mt-30 -64.82 -23.9 67.38 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.622 -0.263 . . . . 0.71999999999999997 111.56 -174.801 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 39.6 ttmt -63.06 -58.93 5.62 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 121.081 0.467 . . . . 2.3599999999999999 110.476 177.284 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -68.15 -32.65 73.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.739 -0.664 . . . . 0.93999999999999995 110.244 178.793 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.449 ' HB3' ' HA ' ' A' ' 28' ' ' GLN . 23.0 tp -62.96 -33.29 75.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.677 -0.692 . . . . 1.3300000000000001 111.332 179.534 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.27 -29.3 70.65 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.954 0.406 . . . . 1.0800000000000001 110.844 178.665 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -79.77 -36.86 36.53 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.068 -0.515 . . . . 1.46 109.678 176.312 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' 0A1 . . . . . 0.474 HMC2 ' HE2' ' A' ' 34' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.456 0 CA-C-N 116.582 -0.281 . . . . 1.1399999999999999 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.244 . . . . . . . . 1.1699999999999999 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_exo -66.04 165.16 24.89 Favored 'Trans proline' 0 C--O 1.236 0.423 0 C-N-CA 122.954 2.436 . . . . 0.96999999999999997 112.189 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_exo -64.59 167.77 14.54 Favored 'Trans proline' 0 C--O 1.237 0.448 0 C-N-CA 122.692 2.261 . . . . 0.56000000000000005 111.58 175.211 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 18.2 p -67.22 111.14 3.79 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 109.974 -0.38 . . . . 0.69999999999999996 109.974 176.461 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.405 ' HA ' ' HD3' ' A' ' 5' ' ' PRO . 0.4 OUTLIER -87.57 147.91 42.84 Favored Pre-proline 0 N--CA 1.449 -0.492 0 CA-C-O 120.755 0.312 . . . . 1.96 110.956 -175.747 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 4' ' ' LYS . 3.3 Cg_endo -84.24 167.45 12.21 Favored 'Trans proline' 0 N--CA 1.453 -0.879 0 C-N-CA 122.902 2.401 . . . . 0.44 112.025 -176.694 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 11.1 t -88.69 138.8 31.09 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 109.69 -0.485 . . . . 0.79000000000000004 109.69 176.508 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.481 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 33.2 mmtp -79.16 128.12 76.99 Favored Pre-proline 0 C--N 1.317 -0.845 0 CA-C-N 116.008 -0.542 . . . . 1.6799999999999999 109.805 -178.944 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.481 ' HD3' ' HA ' ' A' ' 7' ' ' LYS . 0.9 OUTLIER -79.12 94.32 1.07 Allowed 'Trans proline' 0 N--CA 1.455 -0.768 0 C-N-CA 122.235 1.957 . . . . 0.72999999999999998 112.48 -178.715 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -101.2 -71.18 0.92 Allowed Glycine 0 N--CA 1.445 -0.745 0 C-N-CA 120.922 -0.656 . . . . 0.51000000000000001 111.48 175.492 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -85.35 -29.48 24.45 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 121.492 0.663 . . . . 2.4100000000000001 110.311 178.054 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ASN . . . . . 0.468 ' C ' ' H ' ' A' ' 13' ' ' THR . 18.9 t-20 -95.68 22.35 7.3 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.373 -0.83 . . . . 2.4900000000000002 109.281 179.67 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -71.97 31.71 0.05 Allowed 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.569 0.581 . . . . 0.41999999999999998 112.569 -177.438 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.468 ' H ' ' C ' ' A' ' 11' ' ' ASN . 40.5 p -59.96 151.07 66.74 Favored Pre-proline 0 C--N 1.318 -0.765 0 CA-C-N 115.841 -0.618 . . . . 0.73999999999999999 109.982 174.92 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_exo -50.75 -34.42 44.23 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.38 2.053 . . . . 0.68000000000000005 111.846 178.338 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -66.59 -56.24 11.64 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.594 -0.73 . . . . 2.4399999999999999 111.523 179.387 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 17.0 tppt? -70.28 -35.41 73.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.238 0.542 . . . . 1.8 110.373 -176.976 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.637 ' O ' ' HG3' ' A' ' 21' ' ' GLN . 57.7 tp -60.59 -46.81 88.86 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.376 -0.829 . . . . 0.35999999999999999 110.035 177.143 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.42 -37.11 86.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.109 -0.496 . . . . 0.27000000000000002 110.659 178.165 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 29.9 tttm -59.94 -49.8 76.25 Favored 'General case' 0 C--O 1.222 -0.343 0 CA-C-N 116.095 -0.502 . . . . 2.54 109.659 175.817 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' 0A1 . . . . . 0.528 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.637 ' HG3' ' O ' ' A' ' 17' ' ' LEU . 92.5 mt-30 -60.91 -43.9 97.91 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.082 -0.508 . . . . 1.99 111.001 -179.484 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -77.54 -26.25 50.87 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.054 -0.521 . . . . 0.38 111.129 -179.434 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -77.84 -24.3 48.7 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.022 -0.535 . . . . 0.56999999999999995 110.353 -179.001 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.528 ' HG ' ' O ' ' A' ' 20' ' ' 0A1 . 66.9 mt -63.13 -31.11 72.17 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.218 -0.446 . . . . 0.32000000000000001 110.201 173.464 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.45 -19.86 66.12 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.932 -0.576 . . . . 0.37 110.649 176.771 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 30.0 mmmt -90.3 -52.86 4.71 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.603 -0.726 . . . . 2.48 109.578 175.523 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' 0A1 . . . . . 0.425 ' HE2' HMC2 ' A' ' 27' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -65.04 -28.03 69.2 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.555 0.217 . . . . 0.71999999999999997 111.574 -175.599 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 25.2 ttmm -65.27 -54.02 35.52 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-O 120.924 0.392 . . . . 2.3599999999999999 110.419 177.018 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -66.93 -30.89 71.15 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.349 0.595 . . . . 0.93999999999999995 110.112 177.911 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 20.3 tp -63.13 -32.82 74.3 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.399 -0.819 . . . . 1.3300000000000001 111.08 177.938 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.41 -32.27 73.66 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.288 -0.415 . . . . 1.0800000000000001 111.189 178.818 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -80.72 -29.97 36.33 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.383 0.611 . . . . 1.46 109.833 177.513 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.497 0 CA-C-N 116.346 -0.388 . . . . 1.1399999999999999 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.203 . . . . . . . . 1.1699999999999999 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.677 ' HD3' HMC3 ' A' ' 34' ' ' 0A1 . 30.5 Cg_endo -66.87 161.77 40.73 Favored 'Trans proline' 0 C--O 1.234 0.313 0 C-N-CA 122.764 2.309 . . . . 0.96999999999999997 112.27 . . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.433 ' HG2' ' CD2' ' A' ' 27' ' ' 0A1 . 56.8 Cg_endo -78.18 177.56 8.63 Favored 'Trans proline' 0 N--CA 1.46 -0.448 0 C-N-CA 122.522 2.148 . . . . 0.56000000000000005 111.792 176.99 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 19.0 p -59.64 110.12 1.06 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.255 -0.43 . . . . 0.69999999999999996 111.261 179.764 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 16.3 ptmt -94.78 131.88 29.63 Favored Pre-proline 0 C--N 1.325 -0.5 0 CA-C-O 120.936 0.398 . . . . 1.96 110.773 -179.9 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -78.28 144.49 20.69 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 122.256 1.97 . . . . 0.44 111.807 179.688 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 6.0 t -64.27 143.71 57.69 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.978 -0.555 . . . . 0.79000000000000004 111.128 -177.938 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 49.0 mmtm -65.28 128.82 94.13 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 116.006 -0.543 . . . . 1.6799999999999999 110.804 -179.129 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.436 ' O ' ' HB2' ' A' ' 12' ' ' ALA . 73.0 Cg_endo -81.9 92.81 0.97 Allowed 'Trans proline' 0 N--CA 1.456 -0.704 0 C-N-CA 122.416 2.077 . . . . 0.72999999999999998 112.249 175.593 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -100.09 -70.77 0.94 Allowed Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 120.623 -0.798 . . . . 0.51000000000000001 111.594 177.379 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -90.12 -20.79 22.72 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 121.605 0.717 . . . . 2.4100000000000001 110.17 178.156 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 15.4 m120 -99.48 21.2 12.51 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.24 -0.891 . . . . 2.4900000000000002 110.003 -179.842 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.436 ' HB2' ' O ' ' A' ' 8' ' ' PRO . . . -79.64 31.79 0.24 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.903 -0.59 . . . . 0.41999999999999998 112.522 -174.566 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 17.1 p -58.64 150.59 56.53 Favored Pre-proline 0 C--N 1.319 -0.743 0 CA-C-N 116.229 -0.442 . . . . 0.73999999999999999 110.353 175.369 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_exo -50.65 -38.95 56.65 Favored 'Trans proline' 0 C--N 1.343 0.279 0 C-N-CA 122.562 2.174 . . . . 0.68000000000000005 112.197 -179.446 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 37.3 mm-40 -67.99 -42.06 81.37 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 115.941 -0.572 . . . . 2.4399999999999999 111.932 -177.82 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 59.4 tttm -82.99 -28.38 29.73 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.149 0.499 . . . . 1.8 110.252 -178.389 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.463 ' O ' ' HG3' ' A' ' 21' ' ' GLN . 51.1 tp -63.24 -44.31 95.56 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.685 -0.689 . . . . 0.35999999999999999 110.81 178.435 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.94 -36.34 83.09 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.912 0.387 . . . . 0.27000000000000002 110.21 176.46 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -63.36 -39.61 95.0 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.917 -0.583 . . . . 2.54 110.227 175.871 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' 0A1 . . . . . 0.526 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.463 ' HG3' ' O ' ' A' ' 17' ' ' LEU . 76.8 mt-30 -62.67 -42.97 99.9 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.911 -0.586 . . . . 1.99 110.895 177.665 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.19 -36.29 83.14 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.744 -0.662 . . . . 0.38 111.158 179.647 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.492 ' HA ' ' HE2' ' A' ' 26' ' ' LYS . 7.4 t70 -74.87 -31.04 61.51 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.067 0.461 . . . . 0.56999999999999995 109.867 179.118 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.526 ' HG ' ' O ' ' A' ' 20' ' ' 0A1 . 69.2 mt -63.16 -29.95 71.2 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.964 -0.562 . . . . 0.32000000000000001 110.608 174.651 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.75 -28.6 69.55 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.368 0.604 . . . . 0.37 110.701 178.51 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.492 ' HE2' ' HA ' ' A' ' 23' ' ' ASP . 48.7 mtmt -89.84 -46.18 8.74 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.499 -0.773 . . . . 2.48 110.157 176.997 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' 0A1 . . . . . 0.493 HMC2 ' HE1' ' A' ' 27' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 99.1 mt-30 -61.57 -29.1 69.8 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 112.051 0.389 . . . . 0.71999999999999997 112.051 -171.005 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 60.4 tttm -63.22 -59.38 4.82 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 121.051 0.453 . . . . 2.3599999999999999 110.449 179.086 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -68.51 -33.39 74.05 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.961 -0.563 . . . . 0.93999999999999995 110.722 179.818 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -63.7 -34.36 77.68 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.918 -0.583 . . . . 1.3300000000000001 110.184 178.686 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.8 -36.43 83.48 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.171 -0.468 . . . . 1.0800000000000001 111.015 177.167 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -79.42 -21.02 46.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.137 0.494 . . . . 1.46 110.37 179.548 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' 0A1 . . . . . 0.677 HMC3 ' HD3' ' A' ' 1' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.484 0 CA-C-N 116.217 -0.447 . . . . 1.1399999999999999 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.323 . . . . . . . . 1.1699999999999999 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 16.1 Cg_exo -66.1 162.27 36.35 Favored 'Trans proline' 0 N--CA 1.463 -0.304 0 C-N-CA 122.736 2.291 . . . . 0.96999999999999997 111.739 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.43 ' HG2' ' CD2' ' A' ' 27' ' ' 0A1 . 59.5 Cg_endo -79.37 179.8 6.07 Favored 'Trans proline' 0 N--CA 1.457 -0.659 0 C-N-CA 122.464 2.109 . . . . 0.56000000000000005 112.118 179.759 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 2.2 p -62.9 102.44 0.35 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.908 -0.587 . . . . 0.69999999999999996 110.95 177.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 25.1 pttm -90.44 125.07 61.03 Favored Pre-proline 0 N--CA 1.449 -0.516 0 CA-C-O 120.899 0.381 . . . . 1.96 110.727 179.516 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -77.97 157.45 30.78 Favored 'Trans proline' 0 N--CA 1.458 -0.566 0 C-N-CA 122.634 2.223 . . . . 0.44 112.284 -178.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 9.3 t -72.55 145.99 47.05 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.023 -0.535 . . . . 0.79000000000000004 110.285 177.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.462 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 34.4 mmtp -79.16 129.66 71.93 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-N 116.058 -0.519 . . . . 1.6799999999999999 110.603 -177.083 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.462 ' HD3' ' HA ' ' A' ' 7' ' ' LYS . 2.4 Cg_endo -78.12 98.23 1.19 Allowed 'Trans proline' 0 N--CA 1.458 -0.615 0 C-N-CA 122.358 2.039 . . . . 0.72999999999999998 112.109 178.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -100.96 -70.77 0.91 Allowed Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.887 -0.673 . . . . 0.51000000000000001 111.443 175.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -84.74 -27.13 27.15 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.563 0.697 . . . . 2.4100000000000001 110.19 178.102 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . 0.403 ' HB3' ' HD3' ' A' ' 16' ' ' LYS . 16.6 m120 -96.53 21.28 9.45 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.086 -0.961 . . . . 2.4900000000000002 110.138 -178.433 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -76.39 32.15 0.13 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.689 -0.687 . . . . 0.41999999999999998 112.672 -175.043 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 40.6 p -62.5 151.04 84.29 Favored Pre-proline 0 C--N 1.319 -0.741 0 CA-C-N 116.237 -0.438 . . . . 0.73999999999999999 109.893 175.338 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_exo -52.27 -30.17 41.19 Favored 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.501 2.134 . . . . 0.68000000000000005 112.087 179.391 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -67.5 -58.25 5.07 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.408 -0.814 . . . . 2.4399999999999999 111.178 179.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.403 ' HD3' ' HB3' ' A' ' 11' ' ' ASN . 61.2 tttm -74.51 -29.91 61.59 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.103 0.477 . . . . 1.8 110.477 -175.772 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.462 ' O ' ' HG2' ' A' ' 21' ' ' GLN . 56.7 tp -61.52 -38.72 88.4 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.87 -0.604 . . . . 0.35999999999999999 110.252 176.184 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.67 -37.49 82.43 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.238 -0.437 . . . . 0.27000000000000002 110.392 177.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 45.3 tttp -61.01 -44.73 96.98 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.359 0.599 . . . . 2.54 109.678 175.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' 0A1 . . . . . 0.574 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.462 ' HG2' ' O ' ' A' ' 17' ' ' LEU . 86.6 mm-40 -62.63 -41.67 99.15 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.193 -0.458 . . . . 1.99 111.271 179.415 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.3 -30.86 70.83 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.924 -0.58 . . . . 0.38 110.922 179.684 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -79.07 -30.36 43.92 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.169 -0.468 . . . . 0.56999999999999995 110.049 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.574 ' HG ' ' O ' ' A' ' 20' ' ' 0A1 . 65.4 mt -61.42 -27.18 68.36 Favored 'General case' 0 CA--C 1.521 -0.173 0 CA-C-N 115.898 -0.592 . . . . 0.32000000000000001 110.563 175.852 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.05 -30.65 70.45 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.257 0.551 . . . . 0.37 110.627 177.594 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -90.96 -45.9 8.47 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.409 -0.814 . . . . 2.48 110.66 178.059 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' 0A1 . . . . . 0.446 HMC2 ' HE1' ' A' ' 27' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -63.57 -23.28 67.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.451 -0.34 . . . . 0.71999999999999997 111.427 -172.725 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 47.4 tttm -64.39 -57.7 8.56 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 116.16 -0.473 . . . . 2.3599999999999999 110.624 176.659 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -68.62 -34.73 76.26 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.126 0.489 . . . . 0.93999999999999995 110.454 178.055 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -62.78 -39.19 93.44 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.591 -0.731 . . . . 1.3300000000000001 110.422 -178.643 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.3 -36.12 83.07 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 120.943 0.401 . . . . 1.0800000000000001 110.99 178.133 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -70.38 -43.52 69.92 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.14 -0.482 . . . . 1.46 109.881 177.129 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.458 0 CA-C-N 116.572 -0.285 . . . . 1.1399999999999999 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.2 . . . . . . . . 1.1699999999999999 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -71.4 145.48 48.08 Favored 'Trans proline' 0 N--CA 1.452 -0.949 0 C-N-CA 122.282 1.988 . . . . 0.96999999999999997 111.979 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.474 ' HG2' ' CD2' ' A' ' 27' ' ' 0A1 . 41.9 Cg_endo -71.28 -179.41 3.56 Favored 'Trans proline' 0 C--O 1.235 0.335 0 C-N-CA 122.594 2.196 . . . . 0.56000000000000005 112.161 178.731 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 19.7 p -63.42 99.07 0.18 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.019 -0.537 . . . . 0.69999999999999996 111.048 178.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.439 ' HD3' ' H ' ' A' ' 4' ' ' LYS . 0.1 OUTLIER -81.89 129.45 64.7 Favored Pre-proline 0 C--N 1.323 -0.558 0 CA-C-N 116.282 -0.417 . . . . 1.96 110.677 179.069 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -78.88 141.66 17.05 Favored 'Trans proline' 0 N--CA 1.458 -0.587 0 C-N-CA 122.298 1.998 . . . . 0.44 111.827 177.014 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 6.1 t -65.2 141.4 58.67 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.787 -0.449 . . . . 0.79000000000000004 109.787 176.567 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.408 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 27.3 mmtp -80.54 129.59 68.15 Favored Pre-proline 0 C--N 1.321 -0.655 0 CA-C-N 116.277 -0.419 . . . . 1.6799999999999999 110.487 -173.089 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 7' ' ' LYS . 10.3 Cg_exo -69.69 110.2 2.48 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.766 2.311 . . . . 0.72999999999999998 112.699 -176.683 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -100.96 -69.36 0.86 Allowed Glycine 0 N--CA 1.448 -0.551 0 C-N-CA 120.911 -0.661 . . . . 0.51000000000000001 111.56 175.608 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -90.51 -28.87 18.26 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.418 0.628 . . . . 2.4100000000000001 110.584 179.358 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 30.5 p-10 -92.6 20.94 5.83 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.28 -0.873 . . . . 2.4900000000000002 109.974 -178.316 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -77.74 31.56 0.16 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.221 -0.899 . . . . 0.41999999999999998 112.379 -175.026 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 12.0 p -64.03 151.83 88.97 Favored Pre-proline 0 C--N 1.318 -0.795 0 CA-C-N 116.129 -0.487 . . . . 0.73999999999999999 109.974 173.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -57.07 -31.19 89.51 Favored 'Trans proline' 0 C--O 1.233 0.26 0 C-N-CA 122.559 2.173 . . . . 0.68000000000000005 111.785 -177.516 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -63.06 -49.37 74.81 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 115.827 -0.624 . . . . 2.4399999999999999 110.796 178.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.506 ' O ' ' HD3' ' A' ' 16' ' ' LYS . 9.4 tmtt? -81.42 -33.47 32.16 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.983 -0.553 . . . . 1.8 109.747 -177.005 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.402 ' O ' ' HG3' ' A' ' 21' ' ' GLN . 46.4 tp -61.59 -41.69 97.78 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.824 -0.626 . . . . 0.35999999999999999 111.203 -179.342 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.84 -38.28 88.45 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.789 0.328 . . . . 0.27000000000000002 110.537 177.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -63.39 -41.48 98.76 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.837 -0.619 . . . . 2.54 109.917 176.303 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' 0A1 . . . . . 0.474 ' HE1' HMC2 ' A' ' 20' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.402 ' HG3' ' O ' ' A' ' 17' ' ' LEU . 51.1 mt-30 -63.22 -42.37 99.27 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.238 -0.437 . . . . 1.99 111.028 177.364 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.75 -39.38 93.96 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.78 -0.645 . . . . 0.38 110.804 178.673 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -70.33 -32.93 70.87 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.024 -0.535 . . . . 0.56999999999999995 110.367 178.487 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 42.3 mt -61.89 -32.85 73.26 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 116.341 -0.391 . . . . 0.32000000000000001 110.867 176.808 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.93 -25.17 68.2 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.181 0.515 . . . . 0.37 110.617 178.875 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 44.2 mmtm -90.23 -44.38 9.77 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.582 -0.735 . . . . 2.48 109.938 177.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' 0A1 . . . . . 0.474 ' CD2' ' HG2' ' A' ' 2' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 97.2 mt-30 -63.93 -27.66 69.3 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.404 -0.362 . . . . 0.71999999999999997 111.134 -176.098 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 58.6 tttm -64.01 -54.64 31.17 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 120.934 0.397 . . . . 2.3599999999999999 110.619 178.153 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -67.43 -34.86 78.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.096 0.474 . . . . 0.93999999999999995 110.052 178.634 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 21.1 tp -63.2 -34.65 78.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.771 -0.649 . . . . 1.3300000000000001 110.261 177.413 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.37 -32.2 73.56 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.879 -0.601 . . . . 1.0800000000000001 110.664 176.343 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -77.18 -29.42 54.41 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.209 0.528 . . . . 1.46 109.876 177.184 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' 0A1 . . . . . 0.401 HMC2 ' HE1' ' A' ' 34' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.607 0 CA-C-N 116.244 -0.435 . . . . 1.1399999999999999 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.079 . . . . . . . . 1.1699999999999999 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -61.93 167.85 9.82 Favored 'Trans proline' 0 C--O 1.235 0.362 0 C-N-CA 122.931 2.421 . . . . 0.96999999999999997 112.452 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.457 ' HB3' ' OD1' ' A' ' 30' ' ' ASP . 23.2 Cg_endo -64.11 -178.28 0.59 Allowed 'Trans proline' 0 C--O 1.234 0.275 0 C-N-CA 122.614 2.209 . . . . 0.56000000000000005 111.907 174.598 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 22.6 p -61.31 99.98 0.12 Allowed 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.991 -0.549 . . . . 0.69999999999999996 110.814 178.373 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.5 ' HA ' ' HD3' ' A' ' 5' ' ' PRO . 0.2 OUTLIER -82.92 140.74 43.37 Favored Pre-proline 0 N--CA 1.449 -0.521 0 C-N-CA 120.857 -0.337 . . . . 1.96 110.645 -178.815 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.508 ' HB2' ' HD2' ' A' ' 20' ' ' 0A1 . 7.6 Cg_endo -86.62 154.85 8.99 Favored 'Trans proline' 0 N--CA 1.453 -0.897 0 C-N-CA 122.832 2.355 . . . . 0.44 112.326 -176.304 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 13.5 t -70.06 147.54 49.89 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.068 -0.514 . . . . 0.79000000000000004 110.288 178.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 42.4 mmtm -88.21 130.94 44.17 Favored Pre-proline 0 C--N 1.322 -0.608 0 CA-C-N 116.392 -0.367 . . . . 1.6799999999999999 110.632 -174.716 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.44 ' HA ' ' ND2' ' A' ' 11' ' ' ASN . 43.6 Cg_endo -69.76 97.02 0.61 Allowed 'Trans proline' 0 C--O 1.233 0.233 0 C-N-CA 122.627 2.218 . . . . 0.72999999999999998 113.076 -178.41 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -100.44 -72.3 0.99 Allowed Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.362 -0.923 . . . . 0.51000000000000001 111.275 174.268 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -100.0 2.47 43.5 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.583 0.706 . . . . 2.4100000000000001 109.69 175.586 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . 0.477 ' HB2' ' HD3' ' A' ' 16' ' ' LYS . 5.7 p-10 -113.43 21.54 15.07 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 114.878 -1.055 . . . . 2.4900000000000002 109.691 -179.101 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -77.2 14.01 1.01 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.232 -0.894 . . . . 0.41999999999999998 111.887 -175.528 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 1.1 p -60.42 141.49 91.42 Favored Pre-proline 0 N--CA 1.449 -0.504 0 CA-C-N 115.949 -0.569 . . . . 0.73999999999999999 110.561 172.296 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_exo -50.7 -32.4 36.07 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 123.054 2.503 . . . . 0.68000000000000005 113.103 -174.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 21.5 mm-40 -62.2 -47.7 83.29 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.531 -0.304 . . . . 2.4399999999999999 111.334 -177.605 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.477 ' HD3' ' HB2' ' A' ' 11' ' ' ASN . 77.3 tttt -90.36 -28.59 18.6 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.086 0.47 . . . . 1.8 110.279 -178.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.505 ' O ' ' HG2' ' A' ' 21' ' ' GLN . 62.7 tp -62.25 -45.88 91.32 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.792 -0.64 . . . . 0.35999999999999999 110.878 178.456 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.55 -29.45 67.04 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.946 0.403 . . . . 0.27000000000000002 110.649 177.656 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt -68.99 -36.71 78.15 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.345 -0.613 . . . . 2.54 109.345 175.25 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' 0A1 . . . . . 0.508 ' HD2' ' HB2' ' A' ' 5' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.505 ' HG2' ' O ' ' A' ' 17' ' ' LEU . 78.1 mm-40 -62.22 -41.17 98.14 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.108 0.48 . . . . 1.99 110.664 178.664 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.52 -30.85 66.4 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.75 -0.659 . . . . 0.38 111.113 178.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -74.34 -31.6 62.49 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.601 -0.518 . . . . 0.56999999999999995 109.601 177.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' A' ' 20' ' ' 0A1 . 62.9 mt -62.89 -31.42 72.47 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.104 -0.498 . . . . 0.32000000000000001 110.493 174.047 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.19 -22.76 66.94 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.151 0.501 . . . . 0.37 110.615 177.073 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.446 ' O ' ' HB3' ' A' ' 29' ' ' LYS . 58.4 mttp -90.63 -43.98 9.82 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.458 -0.792 . . . . 2.48 109.814 175.165 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.407 ' HA ' ' HB3' ' A' ' 31' ' ' LEU . 79.3 mt-30 -64.2 -23.29 67.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.843 0.354 . . . . 0.71999999999999997 111.015 -177.809 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.446 ' HB3' ' O ' ' A' ' 26' ' ' LYS . 83.0 tttt -63.55 -61.02 2.6 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.9 -0.591 . . . . 2.3599999999999999 110.511 175.845 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.457 ' OD1' ' HB3' ' A' ' 2' ' ' PRO . 16.2 t70 -66.81 -32.11 73.18 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.208 0.528 . . . . 0.93999999999999995 110.205 179.261 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.407 ' HB3' ' HA ' ' A' ' 28' ' ' GLN . 18.3 tp -60.8 -31.42 70.82 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.541 -0.754 . . . . 1.3300000000000001 110.759 179.549 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -62.96 -28.93 70.42 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.865 -0.607 . . . . 1.0800000000000001 111.47 178.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -86.47 -26.13 24.81 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.373 0.606 . . . . 1.46 109.835 177.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.525 0 CA-C-N 116.315 -0.402 . . . . 1.1399999999999999 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.207 . . . . . . . . 1.1699999999999999 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.454 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . 22.6 Cg_exo -63.62 154.51 68.6 Favored 'Trans proline' 0 C--O 1.235 0.326 0 C-N-CA 122.715 2.277 . . . . 0.96999999999999997 111.793 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.454 ' HD3' ' HA ' ' A' ' 1' ' ' PRO . 5.8 Cg_exo -74.26 176.04 10.15 Favored 'Trans proline' 0 N--CA 1.46 -0.479 0 C-N-CA 122.592 2.195 . . . . 0.56000000000000005 111.618 179.818 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 19.7 p -65.83 98.88 0.43 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.18 -0.464 . . . . 0.69999999999999996 110.709 177.139 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.566 ' HB3' ' CE2' ' A' ' 27' ' ' 0A1 . 13.6 ptmt -88.05 127.31 58.0 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-N 116.095 -0.502 . . . . 1.96 111.294 -177.825 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -84.19 136.11 6.64 Favored 'Trans proline' 0 N--CA 1.452 -0.944 0 C-N-CA 122.463 2.109 . . . . 0.44 111.158 176.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 14.2 t -68.0 157.69 34.53 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.366 -0.379 . . . . 0.79000000000000004 110.21 -178.631 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.404 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 1.0 OUTLIER -78.46 128.1 78.73 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-N 116.344 -0.389 . . . . 1.6799999999999999 110.729 -175.41 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 7' ' ' LYS . 6.5 Cg_exo -73.45 121.51 7.2 Favored 'Trans proline' 0 N--CA 1.463 -0.268 0 C-N-CA 122.647 2.231 . . . . 0.72999999999999998 111.788 176.529 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -100.27 -72.12 0.99 Allowed Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.486 -0.864 . . . . 0.51000000000000001 112.013 179.291 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -99.29 -14.65 19.14 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 121.713 0.768 . . . . 2.4100000000000001 109.751 177.083 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 19.3 p-10 -93.65 20.28 7.64 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 114.933 -1.031 . . . . 2.4900000000000002 109.369 177.381 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -85.55 22.99 1.44 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.124 -0.944 . . . . 0.41999999999999998 111.564 -175.239 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 35.6 p -55.26 146.86 39.28 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 116.058 -0.519 . . . . 0.73999999999999999 110.385 177.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -48.29 -31.49 17.4 Favored 'Trans proline' 0 C--N 1.343 0.288 0 C-N-CA 122.723 2.282 . . . . 0.68000000000000005 112.222 178.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -64.65 -54.1 37.16 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.851 -0.613 . . . . 2.4399999999999999 111.48 177.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 15.2 tptm -81.94 -30.8 31.61 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.189 -0.459 . . . . 1.8 110.546 -174.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.448 ' O ' ' HG3' ' A' ' 21' ' ' GLN . 40.9 tp -62.52 -35.52 79.67 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.936 -0.575 . . . . 0.35999999999999999 110.519 177.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.35 -31.94 73.32 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.328 -0.397 . . . . 0.27000000000000002 110.669 177.456 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -72.63 -38.37 67.74 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.646 -0.501 . . . . 2.54 109.646 176.114 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' 0A1 . . . . . 0.505 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.448 ' HG3' ' O ' ' A' ' 17' ' ' LEU . 78.5 mt-30 -61.48 -49.5 76.51 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.961 -0.563 . . . . 1.99 110.741 177.281 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.33 -31.8 73.05 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.616 -0.72 . . . . 0.38 111.461 -179.288 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -76.71 -29.75 56.37 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.174 0.512 . . . . 0.56999999999999995 109.797 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' A' ' 20' ' ' 0A1 . 61.3 mt -63.38 -27.96 69.67 Favored 'General case' 0 C--O 1.225 -0.233 0 CA-C-N 115.803 -0.635 . . . . 0.32000000000000001 110.777 174.408 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.55 -30.15 71.1 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.234 0.54 . . . . 0.37 110.483 178.375 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 72.6 mttt -78.96 -54.53 5.94 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.825 0.822 . . . . 2.48 109.175 175.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' 0A1 . . . . . 0.566 ' CE2' ' HB3' ' A' ' 4' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -62.27 -30.54 71.19 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.512 -0.313 . . . . 0.71999999999999997 111.794 -170.299 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -61.05 -57.97 10.35 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-O 120.756 0.313 . . . . 2.3599999999999999 110.459 179.33 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.431 ' OD1' ' HG3' ' A' ' 2' ' ' PRO . 38.2 t70 -69.48 -33.18 72.49 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.522 -0.308 . . . . 0.93999999999999995 110.661 178.429 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.409 ' HG ' ' CZ ' ' A' ' 27' ' ' 0A1 . 3.2 tm? -62.9 -39.21 93.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.396 -0.365 . . . . 1.3300000000000001 110.622 -178.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.4 -34.44 78.17 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.325 -0.398 . . . . 1.0800000000000001 111.062 178.432 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -82.23 -27.34 32.56 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.319 0.58 . . . . 1.46 110.199 178.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' 0A1 . . . . . 0.436 ' HE1' HMC2 ' A' ' 34' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.376 0 CA-C-N 116.591 -0.277 . . . . 1.1399999999999999 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.178 . . . . . . . . 1.1699999999999999 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.441 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . 21.2 Cg_exo -64.53 156.69 59.27 Favored 'Trans proline' 0 C--O 1.235 0.342 0 C-N-CA 122.692 2.261 . . . . 0.96999999999999997 111.971 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' A' ' 1' ' ' PRO . 14.8 Cg_exo -68.54 -177.64 1.57 Allowed 'Trans proline' 0 C--O 1.235 0.369 0 C-N-CA 122.85 2.367 . . . . 0.56000000000000005 112.171 177.805 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 21.8 p -69.16 94.9 0.71 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.927 -0.579 . . . . 0.69999999999999996 110.275 176.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 55.8 pttt -79.56 137.51 55.17 Favored Pre-proline 0 C--N 1.322 -0.594 0 CA-C-N 116.138 -0.483 . . . . 1.96 110.921 -178.079 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -73.42 151.5 48.01 Favored 'Trans proline' 0 N--CA 1.458 -0.614 0 C-N-CA 122.185 1.923 . . . . 0.44 112.015 178.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 4.4 t -67.97 135.09 51.82 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.021 -0.536 . . . . 0.79000000000000004 110.752 178.417 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -73.07 128.73 87.37 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.826 -0.625 . . . . 1.6799999999999999 110.18 179.618 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.448 ' HA ' ' OD1' ' A' ' 11' ' ' ASN . 61.3 Cg_endo -76.71 83.18 2.13 Favored 'Trans proline' 0 N--CA 1.458 -0.56 0 C-N-CA 122.415 2.077 . . . . 0.72999999999999998 112.669 -179.042 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -101.21 -71.25 0.92 Allowed Glycine 0 N--CA 1.447 -0.609 0 CA-C-N 115.537 -0.756 . . . . 0.51000000000000001 111.586 175.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.4 m-20 -94.33 -9.86 34.57 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.548 0.69 . . . . 2.4100000000000001 109.703 177.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . 0.448 ' OD1' ' HA ' ' A' ' 8' ' ' PRO . 25.2 p-10 -112.86 22.34 14.57 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.845 -1.071 . . . . 2.4900000000000002 110.239 -178.264 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.07 32.49 0.06 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.466 -0.788 . . . . 0.41999999999999998 112.929 -175.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.405 ' H ' ' C ' ' A' ' 11' ' ' ASN . 65.3 p -62.8 149.27 89.98 Favored Pre-proline 0 C--N 1.317 -0.818 0 N-CA-C 110.109 -0.33 . . . . 0.73999999999999999 110.109 175.76 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -51.76 -33.93 52.25 Favored 'Trans proline' 0 C--O 1.232 0.218 0 C-N-CA 122.423 2.082 . . . . 0.68000000000000005 112.043 178.206 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -67.99 -53.64 24.53 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.633 -0.712 . . . . 2.4399999999999999 111.238 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 17.1 tppt? -73.05 -32.7 65.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.908 -0.587 . . . . 1.8 110.311 -177.045 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.417 ' O ' ' HG3' ' A' ' 21' ' ' GLN . 62.3 tp -61.92 -42.32 98.96 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.687 -0.688 . . . . 0.35999999999999999 110.803 177.608 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -70.35 -33.99 72.11 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.39 -0.368 . . . . 0.27000000000000002 110.125 175.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 56.5 tptt -64.4 -40.79 96.49 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.005 -0.543 . . . . 2.54 110.08 175.656 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' 0A1 . . . . . 0.577 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.417 ' HG3' ' O ' ' A' ' 17' ' ' LEU . 78.5 mt-30 -62.27 -48.69 78.78 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.678 -0.692 . . . . 1.99 110.763 177.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.62 -33.82 76.51 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.746 -0.661 . . . . 0.38 111.311 -178.347 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -72.46 -30.29 64.43 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.184 -0.462 . . . . 0.56999999999999995 110.074 -179.607 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.577 ' HG ' ' O ' ' A' ' 20' ' ' 0A1 . 71.3 mt -61.11 -31.62 71.31 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 116.231 -0.44 . . . . 0.32000000000000001 110.581 175.758 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.08 -28.74 70.29 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.252 0.549 . . . . 0.37 110.709 178.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp -90.85 -44.65 9.27 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.465 -0.789 . . . . 2.48 110.448 177.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' 0A1 . . . . . 0.429 ' HE1' HMC2 ' A' ' 27' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -63.48 -29.85 71.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.844 0.354 . . . . 0.71999999999999997 111.266 -174.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 62.9 tttp -64.35 -51.98 60.64 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 115.956 -0.565 . . . . 2.3599999999999999 110.35 177.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -67.5 -36.75 81.67 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.793 -0.639 . . . . 0.93999999999999995 110.299 177.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 34.7 tp -61.36 -34.1 74.74 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.599 -0.728 . . . . 1.3300000000000001 111.089 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.45 -29.54 70.59 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.02 0.438 . . . . 1.0800000000000001 110.84 177.038 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -78.72 -28.85 45.09 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.008 -0.542 . . . . 1.46 110.078 179.452 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.452 0 CA-C-N 116.44 -0.345 . . . . 1.1399999999999999 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.13 . . . . . . . . 1.1699999999999999 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_exo -63.87 166.67 15.56 Favored 'Trans proline' 0 C--O 1.234 0.306 0 C-N-CA 122.78 2.32 . . . . 0.96999999999999997 112.088 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.501 ' HB3' ' OD1' ' A' ' 30' ' ' ASP . 16.9 Cg_exo -67.63 174.52 7.35 Favored 'Trans proline' 0 C--O 1.233 0.245 0 C-N-CA 122.591 2.194 . . . . 0.56000000000000005 111.744 175.755 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.1 p -69.24 94.07 0.67 Allowed 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.182 0.515 . . . . 0.69999999999999996 110.881 177.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.465 ' HA ' ' HD3' ' A' ' 5' ' ' PRO . 11.3 ptmm? -79.42 132.84 61.11 Favored Pre-proline 0 C--N 1.326 -0.422 0 CA-C-N 115.77 -0.65 . . . . 1.96 110.95 -176.388 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.465 ' HD3' ' HA ' ' A' ' 4' ' ' LYS . 3.4 Cg_endo -85.31 167.27 10.6 Favored 'Trans proline' 0 N--CA 1.459 -0.511 0 C-N-CA 122.958 2.439 . . . . 0.44 111.821 -178.903 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 14.2 t -75.38 150.41 38.39 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 110.185 -0.302 . . . . 0.79000000000000004 110.185 179.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.5 mptm? -86.22 136.76 35.39 Favored Pre-proline 0 C--N 1.322 -0.613 0 CA-C-N 116.246 -0.433 . . . . 1.6799999999999999 110.846 -178.058 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.506 ' HA ' ' OD1' ' A' ' 11' ' ' ASN . 36.3 Cg_endo -77.36 93.2 1.09 Allowed 'Trans proline' 0 N--CA 1.453 -0.866 0 C-N-CA 122.498 2.132 . . . . 0.72999999999999998 112.807 -179.546 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -97.43 -71.14 1.04 Allowed Glycine 0 N--CA 1.448 -0.5 0 C-N-CA 120.612 -0.804 . . . . 0.51000000000000001 111.367 175.248 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -97.5 -7.77 30.73 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.502 0.668 . . . . 2.4100000000000001 109.546 174.392 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . 0.506 ' OD1' ' HA ' ' A' ' 8' ' ' PRO . 9.8 p30 -102.56 20.73 16.57 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.313 -0.858 . . . . 2.4900000000000002 109.496 175.58 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.415 ' HA ' ' HB2' ' A' ' 8' ' ' PRO . . . -77.74 20.15 0.35 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.48 -0.782 . . . . 0.41999999999999998 111.306 -178.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 62.0 p -59.18 149.17 69.03 Favored Pre-proline 0 C--N 1.323 -0.558 0 CA-C-N 115.531 -0.759 . . . . 0.73999999999999999 110.334 176.525 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_exo -51.09 -34.64 48.23 Favored 'Trans proline' 0 C--O 1.233 0.242 0 C-N-CA 122.344 2.029 . . . . 0.68000000000000005 112.236 178.521 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 42.5 mm-40 -66.92 -52.72 39.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.993 -0.549 . . . . 2.4399999999999999 111.431 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.511 ' O ' ' HD3' ' A' ' 16' ' ' LYS . 6.7 tmtm? -78.23 -33.39 49.88 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.179 -0.464 . . . . 1.8 109.902 -174.462 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.451 ' O ' ' HG2' ' A' ' 21' ' ' GLN . 49.2 tp -59.96 -44.94 94.12 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.067 -0.515 . . . . 0.35999999999999999 110.549 179.708 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.51 -29.9 70.93 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.057 -0.52 . . . . 0.27000000000000002 110.717 178.717 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 48.0 tptt -74.65 -40.1 61.65 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.047 -0.524 . . . . 2.54 109.828 178.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' 0A1 . . . . . 0.483 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.451 ' HG2' ' O ' ' A' ' 17' ' ' LEU . 80.5 mm-40 -61.25 -43.93 98.07 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.018 -0.537 . . . . 1.99 110.74 176.733 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.16 -37.76 86.43 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.703 -0.68 . . . . 0.38 111.144 178.69 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -75.65 -30.57 59.49 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.822 0.344 . . . . 0.56999999999999995 110.336 179.376 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 20' ' ' 0A1 . 49.7 mt -62.66 -32.37 73.42 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 116.459 -0.337 . . . . 0.32000000000000001 110.688 176.002 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.46 -23.36 67.37 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.33 0.586 . . . . 0.37 110.377 176.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 88.9 mttt -90.36 -48.54 7.06 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.425 -0.807 . . . . 2.48 109.696 176.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -64.63 -32.79 74.61 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.735 0.303 . . . . 0.71999999999999997 110.904 -175.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 59.5 tttm -65.13 -50.43 66.07 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 116.104 -0.498 . . . . 2.3599999999999999 110.212 175.807 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.501 ' OD1' ' HB3' ' A' ' 2' ' ' PRO . 30.4 t70 -65.76 -30.52 71.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.794 -0.639 . . . . 0.93999999999999995 110.282 177.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 18.3 tp -62.69 -40.46 97.17 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.775 -0.648 . . . . 1.3300000000000001 110.574 176.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.76 -35.41 80.63 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.096 -0.502 . . . . 1.0800000000000001 111.111 178.006 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -72.98 -39.99 65.66 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.003 0.43 . . . . 1.46 110.234 177.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' 0A1 . . . . . 0.456 ' HE1' HMC2 ' A' ' 34' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.553 0 CA-C-N 116.546 -0.297 . . . . 1.1399999999999999 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.228 -0.055 . . . . . . . . 1.1699999999999999 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -63.49 159.26 41.24 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.752 2.301 . . . . 0.96999999999999997 113.172 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.432 ' HG2' ' CD2' ' A' ' 27' ' ' 0A1 . 34.7 Cg_endo -68.94 175.29 7.6 Favored 'Trans proline' 0 N--CA 1.464 -0.235 0 C-N-CA 122.742 2.295 . . . . 0.56000000000000005 111.62 175.728 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 6.2 p -61.41 107.52 0.79 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.435 -0.348 . . . . 0.69999999999999996 111.326 179.85 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -89.4 122.4 68.47 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 116.121 -0.49 . . . . 1.96 110.666 -178.714 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.437 ' HB2' ' HD2' ' A' ' 20' ' ' 0A1 . 57.1 Cg_endo -74.25 147.61 37.71 Favored 'Trans proline' 0 N--CA 1.459 -0.514 0 C-N-CA 122.359 2.04 . . . . 0.44 112.313 -178.642 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 9.3 t -73.74 148.22 42.81 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.853 -0.612 . . . . 0.79000000000000004 110.616 -179.464 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp -73.66 130.19 84.07 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 116.447 -0.342 . . . . 1.6799999999999999 110.516 -179.277 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -72.87 96.46 0.85 Allowed 'Trans proline' 0 N--CA 1.462 -0.338 0 C-N-CA 122.577 2.185 . . . . 0.72999999999999998 112.28 -179.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -100.65 -70.91 0.93 Allowed Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.794 -0.717 . . . . 0.51000000000000001 112.65 179.714 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -93.77 -24.12 17.92 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.601 0.715 . . . . 2.4100000000000001 110.249 -178.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 16.2 m120 -99.26 21.35 12.05 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.218 -0.901 . . . . 2.4900000000000002 109.765 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -72.38 23.99 0.05 Allowed 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 113.174 0.805 . . . . 0.41999999999999998 113.174 -172.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 16.2 p -53.13 149.34 13.0 Favored Pre-proline 0 C--N 1.322 -0.609 0 O-C-N 123.151 0.282 . . . . 0.73999999999999999 110.772 174.331 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -55.53 -32.21 81.78 Favored 'Trans proline' 0 N--CA 1.464 -0.231 0 C-N-CA 122.813 2.342 . . . . 0.68000000000000005 111.93 -176.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -63.95 -52.07 61.46 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.755 -0.657 . . . . 2.4399999999999999 110.566 178.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 56.3 tttm -75.63 -31.55 59.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.034 -0.53 . . . . 1.8 110.199 -177.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.544 ' O ' ' HG2' ' A' ' 21' ' ' GLN . 62.1 tp -62.82 -48.93 76.95 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.73 -0.668 . . . . 0.35999999999999999 110.961 -179.793 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.53 -32.84 73.9 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.931 0.396 . . . . 0.27000000000000002 110.51 177.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt -67.47 -36.52 81.29 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.632 -0.507 . . . . 2.54 109.632 177.034 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' 0A1 . . . . . 0.48 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.544 ' HG2' ' O ' ' A' ' 17' ' ' LEU . 82.4 mm-40 -63.41 -41.96 98.73 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.978 -0.555 . . . . 1.99 110.842 178.613 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.23 -34.23 77.03 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.111 -0.495 . . . . 0.38 110.797 178.032 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -70.18 -33.36 71.64 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.964 -0.562 . . . . 0.56999999999999995 110.185 178.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.48 ' HG ' ' O ' ' A' ' 20' ' ' 0A1 . 58.0 mt -61.9 -32.8 73.22 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.951 -0.568 . . . . 0.32000000000000001 110.752 176.738 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.71 -25.64 68.29 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.991 -0.55 . . . . 0.37 110.819 178.673 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -90.23 -47.46 7.77 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.651 -0.704 . . . . 2.48 110.259 177.494 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' 0A1 . . . . . 0.478 ' HE1' HMC2 ' A' ' 27' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.498 ' HA ' ' HB3' ' A' ' 31' ' ' LEU . 76.9 mt-30 -64.42 -22.79 67.07 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.443 -0.344 . . . . 0.71999999999999997 111.858 -176.785 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 60.9 tttm -63.74 -59.01 5.11 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 121.122 0.486 . . . . 2.3599999999999999 110.233 176.444 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -68.79 -31.74 70.98 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.967 -0.56 . . . . 0.93999999999999995 110.396 178.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.498 ' HB3' ' HA ' ' A' ' 28' ' ' GLN . 31.5 tp -62.1 -33.95 75.41 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.842 -0.617 . . . . 1.3300000000000001 110.978 179.086 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.27 -30.45 71.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.206 -0.452 . . . . 1.0800000000000001 110.831 177.214 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -84.71 -33.48 23.14 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.108 -0.497 . . . . 1.46 110.192 177.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' 0A1 . . . . . 0.414 ' HE2' HMC2 ' A' ' 34' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.452 0 CA-C-N 116.521 -0.309 . . . . 1.1399999999999999 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 0' ' ' ACE . . . . . 0.542 ' H2 ' HMC2 ' A' ' 34' ' ' 0A1 . . . . . . . . 0 C--O 1.232 0.147 . . . . . . . . 1.1699999999999999 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -64.42 164.88 21.75 Favored 'Trans proline' 0 C--O 1.234 0.298 0 C-N-CA 122.592 2.195 . . . . 0.96999999999999997 112.21 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.457 ' HG2' ' CD2' ' A' ' 27' ' ' 0A1 . 29.5 Cg_endo -67.07 178.89 2.63 Favored 'Trans proline' 0 N--CA 1.462 -0.339 0 C-N-CA 122.482 2.121 . . . . 0.56000000000000005 111.752 174.271 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.7 p -74.16 113.32 11.22 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 116.152 -0.476 . . . . 0.69999999999999996 111.311 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.439 ' HA ' ' HD3' ' A' ' 5' ' ' PRO . 14.7 ptmt -91.83 138.33 24.97 Favored Pre-proline 0 C--N 1.322 -0.593 0 CA-C-N 116.032 -0.531 . . . . 1.96 110.204 178.719 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 4' ' ' LYS . 55.9 Cg_endo -83.88 169.35 11.85 Favored 'Trans proline' 0 N--CA 1.456 -0.696 0 C-N-CA 122.446 2.097 . . . . 0.44 112.994 -175.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 11.8 t -78.51 148.49 33.43 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.799 -0.637 . . . . 0.79000000000000004 110.64 -179.629 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp -79.94 129.24 71.19 Favored Pre-proline 0 C--N 1.323 -0.547 0 CA-C-N 116.151 -0.477 . . . . 1.6799999999999999 110.761 -179.419 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -80.91 101.72 1.31 Allowed 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 122.573 2.182 . . . . 0.72999999999999998 112.503 177.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -100.27 -70.69 0.93 Allowed Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.753 -0.737 . . . . 0.51000000000000001 112.148 178.397 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -98.49 -26.7 14.35 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.475 0.655 . . . . 2.4100000000000001 110.381 177.479 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -89.37 21.01 3.51 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.412 -0.813 . . . . 2.4900000000000002 109.444 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -76.97 27.86 0.14 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.258 -0.883 . . . . 0.41999999999999998 112.667 -173.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 19.2 p -58.17 154.23 31.81 Favored Pre-proline 0 C--N 1.322 -0.628 0 CA-C-N 116.439 -0.346 . . . . 0.73999999999999999 110.319 177.474 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_exo -49.92 -32.93 31.93 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.624 2.216 . . . . 0.68000000000000005 112.079 -179.73 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -64.72 -50.48 66.77 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.64 -0.709 . . . . 2.4399999999999999 111.429 -179.194 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 75.3 tttt -85.34 -28.22 25.37 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.873 0.368 . . . . 1.8 110.867 -176.047 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.453 ' O ' ' HG3' ' A' ' 21' ' ' GLN . 57.3 tp -61.4 -46.92 88.15 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.115 -0.493 . . . . 0.35999999999999999 110.238 177.117 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.98 -31.95 72.02 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.153 -0.476 . . . . 0.27000000000000002 110.719 177.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -65.56 -41.72 92.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.264 0.554 . . . . 2.54 109.897 176.701 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' 0A1 . . . . . 0.525 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.453 ' HG3' ' O ' ' A' ' 17' ' ' LEU . 97.2 mt-30 -63.35 -41.46 98.86 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.9 -0.591 . . . . 1.99 111.131 178.747 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.03 -40.65 96.79 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.984 -0.553 . . . . 0.38 110.806 178.595 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -69.72 -32.07 70.44 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.254 -0.43 . . . . 0.56999999999999995 110.152 179.106 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' A' ' 20' ' ' 0A1 . 59.6 mt -61.31 -30.94 70.8 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 116.152 -0.476 . . . . 0.32000000000000001 110.794 175.729 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.44 -25.11 67.87 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.11 0.481 . . . . 0.37 110.723 178.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 46.2 mmtm -90.78 -49.13 6.62 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.648 -0.705 . . . . 2.48 109.833 177.108 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' 0A1 . . . . . 0.457 ' CD2' ' HG2' ' A' ' 2' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -64.07 -29.33 70.47 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.71 0.263 . . . . 0.71999999999999997 111.71 -176.667 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 61.6 tttp -63.69 -55.8 20.6 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-O 121.024 0.44 . . . . 2.3599999999999999 110.296 177.683 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -66.84 -31.99 72.96 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.846 -0.616 . . . . 0.93999999999999995 110.521 178.378 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 32.5 tp -62.53 -35.94 81.04 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.196 -0.456 . . . . 1.3300000000000001 110.516 178.646 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.51 -35.74 81.77 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.224 -0.444 . . . . 1.0800000000000001 110.103 174.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -69.85 -38.05 76.35 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.628 -0.715 . . . . 1.46 110.413 175.589 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' 0A1 . . . . . 0.542 HMC2 ' H2 ' ' A' ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.491 0 CA-C-N 116.352 -0.386 . . . . 1.1399999999999999 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.224 . . . . . . . . 1.1699999999999999 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 16.4 Cg_exo -65.47 156.58 62.74 Favored 'Trans proline' 0 N--CA 1.463 -0.288 0 C-N-CA 122.67 2.247 . . . . 0.96999999999999997 111.66 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.419 ' HB2' ' HD2' ' A' ' 27' ' ' 0A1 . 7.4 Cg_exo -70.41 176.25 7.53 Favored 'Trans proline' 0 C--O 1.235 0.338 0 C-N-CA 122.524 2.149 . . . . 0.56000000000000005 112.084 -179.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.2 p -70.21 101.66 1.92 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.151 -0.477 . . . . 0.69999999999999996 111.136 178.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 54.0 pttt -90.34 126.44 56.62 Favored Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 116.109 -0.496 . . . . 1.96 111.446 -176.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -75.92 159.24 38.18 Favored 'Trans proline' 0 N--CA 1.461 -0.428 0 C-N-CA 122.725 2.284 . . . . 0.44 112.207 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 9.0 t -72.22 140.65 48.8 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.159 -0.473 . . . . 0.79000000000000004 111.329 -177.198 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 34.6 mmtp -69.66 129.58 91.19 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 115.596 -0.729 . . . . 1.6799999999999999 110.661 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.506 ' HA ' ' OD1' ' A' ' 11' ' ' ASN . 58.0 Cg_endo -74.04 97.38 1.0 Allowed 'Trans proline' 0 C--O 1.235 0.363 0 C-N-CA 122.592 2.195 . . . . 0.72999999999999998 112.877 -179.615 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -101.26 -71.5 0.93 Allowed Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.93 -0.652 . . . . 0.51000000000000001 111.727 176.361 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -93.99 -20.51 19.91 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.942 0.877 . . . . 2.4100000000000001 109.196 174.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . 0.517 ' O ' ' HB3' ' A' ' 16' ' ' LYS . 22.2 p-10 -94.73 21.32 7.55 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 114.439 -1.255 . . . . 2.4900000000000002 109.787 -178.542 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -78.54 19.05 0.5 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.879 -0.601 . . . . 0.41999999999999998 111.806 -177.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 19.3 p -60.85 149.89 78.95 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-N 116.099 -0.5 . . . . 0.73999999999999999 110.541 177.443 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -52.34 -29.06 37.25 Favored 'Trans proline' 0 C--N 1.343 0.274 0 C-N-CA 122.594 2.196 . . . . 0.68000000000000005 112.731 -179.535 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -65.35 -53.81 38.13 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.099 0.476 . . . . 2.4399999999999999 110.613 177.038 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.517 ' HB3' ' O ' ' A' ' 11' ' ' ASN . 42.8 tptt -81.15 -32.17 33.81 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.856 -0.611 . . . . 1.8 110.872 -174.533 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.437 ' O ' ' HG2' ' A' ' 21' ' ' GLN . 54.4 tp -62.28 -47.52 83.96 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.168 -0.469 . . . . 0.35999999999999999 111.086 -179.334 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.07 -31.55 72.83 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.973 0.416 . . . . 0.27000000000000002 110.192 177.837 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 57.9 tttm -69.3 -39.46 78.28 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.721 -0.672 . . . . 2.54 109.718 176.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' 0A1 . . . . . 0.476 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.437 ' HG2' ' O ' ' A' ' 17' ' ' LEU . 81.2 mm-40 -62.51 -44.63 95.88 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.013 -0.539 . . . . 1.99 110.895 177.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.92 -25.52 67.91 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.824 -0.625 . . . . 0.38 110.899 178.727 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -80.87 -37.31 30.05 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.425 -0.583 . . . . 0.56999999999999995 109.425 178.343 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.476 ' HG ' ' O ' ' A' ' 20' ' ' 0A1 . 67.8 mt -61.85 -31.18 71.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.794 -0.639 . . . . 0.32000000000000001 110.785 176.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.71 -30.85 70.21 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.307 0.575 . . . . 0.37 110.668 178.04 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 55.1 mttp -90.38 -46.02 8.64 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.463 -0.79 . . . . 2.48 110.062 178.773 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' 0A1 . . . . . 0.466 ' HE1' HMC2 ' A' ' 27' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.455 ' HA ' ' HB3' ' A' ' 31' ' ' LEU . 99.0 mt-30 -61.04 -30.08 70.1 Favored 'General case' 0 N--CA 1.463 0.217 0 O-C-N 123.029 0.206 . . . . 0.71999999999999997 111.55 -172.468 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 53.3 tttp -62.05 -53.37 56.54 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-O 121.137 0.494 . . . . 2.3599999999999999 110.07 177.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -70.34 -33.67 71.76 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.79 -0.641 . . . . 0.93999999999999995 110.568 178.006 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.455 ' HB3' ' HA ' ' A' ' 28' ' ' GLN . 2.9 tm? -64.34 -37.61 88.13 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.649 -0.705 . . . . 1.3300000000000001 110.541 -178.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.0 -28.96 69.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.025 0.44 . . . . 1.0800000000000001 110.715 175.621 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -74.47 -36.04 63.31 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.805 -0.634 . . . . 1.46 109.549 175.54 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.541 0 CA-C-N 116.421 -0.354 . . . . 1.1399999999999999 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.177 . . . . . . . . 1.1699999999999999 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.454 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . 23.0 Cg_exo -62.22 152.46 76.09 Favored 'Trans proline' 0 C--O 1.235 0.36 0 C-N-CA 122.448 2.099 . . . . 0.96999999999999997 111.721 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.454 ' HD3' ' HA ' ' A' ' 1' ' ' PRO . 2.9 Cg_exo -72.53 172.45 15.08 Favored 'Trans proline' 0 N--CA 1.458 -0.562 0 C-N-CA 122.412 2.075 . . . . 0.56000000000000005 111.48 179.612 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 7.2 p -70.94 91.04 0.84 Allowed 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 120.942 0.401 . . . . 0.69999999999999996 111.424 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.445 ' HD3' ' H ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -57.98 126.27 76.56 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 116.009 -0.541 . . . . 1.96 110.263 174.316 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.429 ' HD3' ' HA ' ' A' ' 4' ' ' LYS . 10.5 Cg_exo -69.47 157.62 60.27 Favored 'Trans proline' 0 N--CA 1.463 -0.28 0 C-N-CA 122.508 2.139 . . . . 0.44 111.802 -179.251 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 5.6 t -64.81 138.24 58.26 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.078 0.466 . . . . 0.79000000000000004 109.835 176.232 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.468 ' HD3' ' N ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -79.99 129.9 68.63 Favored Pre-proline 0 C--N 1.318 -0.787 0 CA-C-N 115.949 -0.569 . . . . 1.6799999999999999 111.103 -175.318 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -71.11 88.6 0.69 Allowed 'Trans proline' 0 C--O 1.235 0.374 0 C-N-CA 122.81 2.34 . . . . 0.72999999999999998 112.992 179.207 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -101.58 -71.27 0.91 Allowed Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 121.011 -0.614 . . . . 0.51000000000000001 112.032 176.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -92.87 -25.46 18.07 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.631 0.729 . . . . 2.4100000000000001 110.3 179.185 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 18.2 m120 -97.62 22.19 9.32 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.07 -0.968 . . . . 2.4900000000000002 110.48 -179.867 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -73.65 31.47 0.07 Allowed 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 112.843 0.683 . . . . 0.41999999999999998 112.843 -174.502 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 47.9 p -66.1 148.52 98.37 Favored Pre-proline 0 C--N 1.316 -0.874 0 N-CA-C 109.987 -0.375 . . . . 0.73999999999999999 109.987 176.052 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -53.12 -30.2 49.03 Favored 'Trans proline' 0 C--N 1.342 0.225 0 C-N-CA 122.466 2.111 . . . . 0.68000000000000005 112.161 179.194 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -64.98 -51.08 63.71 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 116.209 -0.45 . . . . 2.4399999999999999 111.186 179.422 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 56.4 tttp -79.61 -33.78 41.22 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.17 -0.468 . . . . 1.8 110.512 -177.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.403 ' O ' ' HG3' ' A' ' 21' ' ' GLN . 56.8 tp -60.86 -38.99 87.47 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.843 -0.617 . . . . 0.35999999999999999 111.06 -179.493 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.18 -35.7 81.14 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.706 0.289 . . . . 0.27000000000000002 110.471 176.563 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 41.4 ttmt -67.54 -37.55 82.88 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.167 -0.47 . . . . 2.54 109.889 177.333 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' 0A1 . . . . . 0.514 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.403 ' HG3' ' O ' ' A' ' 17' ' ' LEU . 48.4 mt-30 -61.47 -39.18 89.95 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.609 -0.723 . . . . 1.99 110.937 179.051 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.09 -31.39 66.02 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.568 -0.742 . . . . 0.38 111.233 179.308 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -78.53 -23.3 46.3 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.117 0.484 . . . . 0.56999999999999995 110.03 -179.121 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.514 ' HG ' ' O ' ' A' ' 20' ' ' 0A1 . 75.7 mt -61.99 -25.24 67.52 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.901 -0.59 . . . . 0.32000000000000001 110.192 173.134 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.481 ' O ' ' HE2' ' A' ' 29' ' ' LYS . . . -64.99 -19.61 66.08 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.04 0.448 . . . . 0.37 110.843 175.727 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 52.1 mttp -90.03 -55.34 3.66 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.221 -0.659 . . . . 2.48 109.221 173.571 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' 0A1 . . . . . 0.415 HMC2 ' HE1' ' A' ' 27' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 94.9 mt-30 -63.29 -36.38 83.5 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.759 0.314 . . . . 0.71999999999999997 111.054 -173.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.481 ' HE2' ' O ' ' A' ' 25' ' ' ALA . 22.4 ttmm -63.31 -53.11 57.86 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 116.18 -0.464 . . . . 2.3599999999999999 110.383 179.522 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -68.9 -27.88 66.18 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.854 -0.612 . . . . 0.93999999999999995 110.747 179.661 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 31.3 tp -61.61 -39.65 91.99 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.295 -0.411 . . . . 1.3300000000000001 110.748 179.435 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.32 -33.45 76.01 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.148 0.499 . . . . 1.0800000000000001 110.461 176.586 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -74.24 -35.36 63.83 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.624 -0.716 . . . . 1.46 110.339 177.738 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' 0A1 . . . . . 0.431 HMC2 ' HE2' ' A' ' 34' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.512 0 CA-C-N 116.455 -0.338 . . . . 1.1399999999999999 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.277 . . . . . . . . 1.1699999999999999 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.448 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . 25.7 Cg_exo -62.24 155.9 53.94 Favored 'Trans proline' 0 C--O 1.234 0.323 0 C-N-CA 122.67 2.247 . . . . 0.96999999999999997 111.907 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' A' ' 1' ' ' PRO . 3.9 Cg_exo -74.23 -176.86 2.9 Favored 'Trans proline' 0 N--CA 1.461 -0.426 0 C-N-CA 122.7 2.267 . . . . 0.56000000000000005 111.681 177.583 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 12.8 p -72.65 87.79 1.25 Allowed 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.82 -0.627 . . . . 0.69999999999999996 111.271 179.525 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.492 ' HB3' HMC2 ' A' ' 27' ' ' 0A1 . 0.0 OUTLIER -61.16 123.85 77.68 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 115.949 -0.568 . . . . 1.96 110.826 177.064 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 4' ' ' LYS . 4.7 Cg_exo -76.13 156.0 37.95 Favored 'Trans proline' 0 N--CA 1.459 -0.524 0 C-N-CA 122.594 2.196 . . . . 0.44 111.837 177.371 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 8.1 t -74.67 135.94 41.89 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.275 0.559 . . . . 0.79000000000000004 110.521 179.637 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 45.8 mmtm -68.93 136.31 89.75 Favored Pre-proline 0 C--N 1.324 -0.527 0 CA-C-N 115.354 -0.839 . . . . 1.6799999999999999 110.96 -176.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -70.84 81.16 1.12 Allowed 'Trans proline' 0 N--CA 1.459 -0.526 0 C-N-CA 122.422 2.082 . . . . 0.72999999999999998 113.145 -179.34 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -100.57 -68.76 0.86 Allowed Glycine 0 N--CA 1.444 -0.806 0 N-CA-C 109.973 -1.251 . . . . 0.51000000000000001 109.973 170.532 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -89.42 -16.16 31.56 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 121.927 0.87 . . . . 2.4100000000000001 108.92 172.778 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . 0.422 HD22 ' N ' ' A' ' 11' ' ' ASN . 0.9 OUTLIER -96.25 21.06 9.44 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 114.76 -1.109 . . . . 2.4900000000000002 110.128 179.156 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -84.61 14.78 4.27 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.094 -0.503 . . . . 0.41999999999999998 112.179 -174.453 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 12.8 p -63.28 146.99 95.67 Favored Pre-proline 0 C--N 1.325 -0.494 0 N-CA-C 109.672 -0.492 . . . . 0.73999999999999999 109.672 174.422 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -51.64 -31.51 40.88 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.306 2.004 . . . . 0.68000000000000005 112.245 -178.117 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 56.0 mm-40 -66.69 -60.1 3.0 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.94 -0.573 . . . . 2.4399999999999999 111.183 177.878 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.416 ' HB3' ' O ' ' A' ' 11' ' ' ASN . 21.2 tptm -72.95 -30.17 63.65 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.819 -0.628 . . . . 1.8 110.676 -173.904 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.51 ' HG ' HE21 ' A' ' 21' ' ' GLN . 60.1 tp -61.24 -46.45 90.34 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.748 -0.66 . . . . 0.35999999999999999 110.727 177.348 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.26 -38.55 88.09 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.328 -0.396 . . . . 0.27000000000000002 110.318 178.191 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.499 ' C ' ' HD3' ' A' ' 19' ' ' LYS . 1.0 OUTLIER -60.99 -42.74 98.99 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.949 -0.569 . . . . 2.54 109.47 176.793 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' 0A1 . . . . . 0.486 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.51 HE21 ' HG ' ' A' ' 17' ' ' LEU . 78.4 mt-30 -59.55 -43.37 93.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.181 0.515 . . . . 1.99 110.83 179.578 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -74.31 -29.61 61.7 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.438 -0.801 . . . . 0.38 111.468 -179.006 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -77.74 -24.19 49.13 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.038 0.447 . . . . 0.56999999999999995 110.178 -179.023 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.486 ' HG ' ' O ' ' A' ' 20' ' ' 0A1 . 60.6 mt -61.89 -31.15 71.41 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.913 -0.585 . . . . 0.32000000000000001 110.228 173.567 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.61 -22.22 66.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.044 0.45 . . . . 0.37 110.898 178.309 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 56.0 mttp -89.76 -49.68 6.5 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.798 -0.637 . . . . 2.48 109.703 176.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' 0A1 . . . . . 0.492 HMC2 ' HB3' ' A' ' 4' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 -64.77 -25.24 67.84 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.139 -0.482 . . . . 0.71999999999999997 111.886 -174.772 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 55.7 tttp -65.14 -57.68 7.96 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-O 120.843 0.354 . . . . 2.3599999999999999 110.583 179.097 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.401 ' OD1' ' HG3' ' A' ' 2' ' ' PRO . 16.1 t70 -65.01 -34.8 79.31 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.144 -0.48 . . . . 0.93999999999999995 110.047 178.234 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 20.8 tp -63.14 -40.52 97.81 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.982 -0.554 . . . . 1.3300000000000001 110.862 179.862 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.82 -36.05 82.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.942 0.401 . . . . 1.0800000000000001 110.802 178.486 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -72.35 -39.39 68.15 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.938 -0.574 . . . . 1.46 109.768 177.777 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' 0A1 . . . . . 0.437 HMC3 ' HE2' ' A' ' 34' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.394 0 CA-C-N 116.645 -0.252 . . . . 1.1399999999999999 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.211 . . . . . . . . 1.1699999999999999 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.512 ' HD3' HMC3 ' A' ' 34' ' ' 0A1 . 18.9 Cg_exo -64.65 153.45 77.4 Favored 'Trans proline' 0 N--CA 1.46 -0.457 0 C-N-CA 122.498 2.132 . . . . 0.96999999999999997 111.685 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.443 ' HD2' HD23 ' A' ' 31' ' ' LEU . 11.1 Cg_exo -69.78 167.94 23.03 Favored 'Trans proline' 0 C--O 1.235 0.362 0 C-N-CA 122.428 2.085 . . . . 0.56000000000000005 111.32 178.047 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.5 p -68.91 89.74 0.42 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.105 0.479 . . . . 0.69999999999999996 111.625 -178.534 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.43 ' HD3' ' H ' ' A' ' 4' ' ' LYS . 0.2 OUTLIER -58.62 131.86 85.69 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 115.543 -0.753 . . . . 1.96 111.091 176.914 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -67.02 151.29 82.19 Favored 'Trans proline' 0 C--O 1.235 0.369 0 C-N-CA 122.916 2.41 . . . . 0.44 112.687 -177.628 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 4.8 t -63.1 134.94 56.85 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.788 -0.642 . . . . 0.79000000000000004 111.021 178.346 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.462 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 72.7 mmtt -74.11 127.65 87.63 Favored Pre-proline 0 C--N 1.323 -0.565 0 CA-C-N 115.82 -0.627 . . . . 1.6799999999999999 110.301 -179.401 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.462 ' HD3' ' HA ' ' A' ' 7' ' ' LYS . 4.2 Cg_exo -78.59 102.93 1.6 Allowed 'Trans proline' 0 N--CA 1.456 -0.686 0 C-N-CA 122.708 2.272 . . . . 0.72999999999999998 112.228 179.074 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -100.69 -70.29 0.9 Allowed Glycine 0 N--CA 1.444 -0.778 0 CA-C-N 115.807 -0.633 . . . . 0.51000000000000001 111.586 175.152 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -87.62 -29.95 20.82 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.424 0.63 . . . . 2.4100000000000001 110.536 178.814 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 19.4 m120 -92.24 21.74 4.96 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.316 -0.856 . . . . 2.4900000000000002 109.789 -179.545 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -74.65 28.72 0.09 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.413 -0.812 . . . . 0.41999999999999998 112.774 -174.645 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 32.9 p -70.37 152.54 95.51 Favored Pre-proline 0 C--N 1.316 -0.873 0 N-CA-C 109.65 -0.5 . . . . 0.73999999999999999 109.65 176.275 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -52.33 -24.74 22.09 Favored 'Trans proline' 0 C--N 1.343 0.272 0 C-N-CA 122.751 2.3 . . . . 0.68000000000000005 112.601 178.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -62.7 -50.72 70.03 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 116.114 -0.494 . . . . 2.4399999999999999 110.795 177.633 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 52.6 tttp -89.89 -33.72 16.34 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.164 -0.471 . . . . 1.8 110.687 -177.137 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.606 ' O ' ' HG2' ' A' ' 21' ' ' GLN . 54.1 tp -60.79 -44.63 96.56 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.943 -0.571 . . . . 0.35999999999999999 111.012 -178.33 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.46 -33.0 74.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.606 0.241 . . . . 0.27000000000000002 110.85 179.268 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -72.98 -34.4 66.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.234 0.54 . . . . 2.54 109.685 178.194 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' 0A1 . . . . . 0.441 ' HE1' HMC2 ' A' ' 20' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.606 ' HG2' ' O ' ' A' ' 17' ' ' LEU . 87.8 mm-40 -62.98 -40.53 98.03 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.787 -0.642 . . . . 1.99 110.911 177.695 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.13 -37.51 83.96 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.933 -0.576 . . . . 0.38 110.925 179.27 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -69.4 -35.46 75.79 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.088 -0.505 . . . . 0.56999999999999995 110.095 178.729 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.431 ' HG ' ' O ' ' A' ' 20' ' ' 0A1 . 54.3 mt -61.84 -31.63 71.9 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.026 -0.534 . . . . 0.32000000000000001 110.833 176.154 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.87 -30.9 71.17 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.235 0.54 . . . . 0.37 110.673 179.128 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 65.8 mttm -90.84 -43.47 10.02 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.368 -0.833 . . . . 2.48 110.594 178.074 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' 0A1 . . . . . 0.428 ' HE1' HMC2 ' A' ' 27' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 95.1 mt-30 -61.66 -27.02 68.38 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.845 0.355 . . . . 0.71999999999999997 110.848 -174.393 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -61.95 -60.14 4.07 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 115.913 -0.585 . . . . 2.3599999999999999 110.283 178.418 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -68.87 -33.76 74.32 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.844 -0.616 . . . . 0.93999999999999995 110.902 178.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.443 HD23 ' HD2' ' A' ' 2' ' ' PRO . 3.3 tm? -61.53 -42.42 98.78 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.858 -0.61 . . . . 1.3300000000000001 110.127 179.849 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -62.44 -42.09 99.2 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.198 -0.456 . . . . 1.0800000000000001 110.539 177.101 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -63.96 -42.48 97.27 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.731 -0.668 . . . . 1.46 110.826 179.29 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' 0A1 . . . . . 0.512 HMC3 ' HD3' ' A' ' 1' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.553 0 CA-C-N 116.342 -0.39 . . . . 1.1399999999999999 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.262 . . . . . . . . 1.1699999999999999 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.432 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . 26.8 Cg_exo -62.29 150.79 85.78 Favored 'Trans proline' 0 CA--C 1.531 0.331 0 C-N-CA 122.384 2.056 . . . . 0.96999999999999997 111.825 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.432 ' HD3' ' HA ' ' A' ' 1' ' ' PRO . 3.1 Cg_exo -78.67 176.84 9.42 Favored 'Trans proline' 0 N--CA 1.46 -0.471 0 C-N-CA 122.802 2.334 . . . . 0.56000000000000005 111.947 -178.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 9.3 p -66.31 100.36 0.62 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.087 -0.506 . . . . 0.69999999999999996 110.998 179.524 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.437 ' HA ' ' HD3' ' A' ' 5' ' ' PRO . 23.8 pttm -80.48 127.74 74.85 Favored Pre-proline 0 C--O 1.236 0.365 0 CA-C-N 116.335 -0.393 . . . . 1.96 110.577 -179.438 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.468 ' HB2' ' HD2' ' A' ' 20' ' ' 0A1 . 4.1 Cg_exo -75.39 158.0 40.87 Favored 'Trans proline' 0 N--CA 1.46 -0.465 0 C-N-CA 122.675 2.25 . . . . 0.44 112.6 -175.858 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.8 t -67.03 140.88 57.69 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.695 -0.684 . . . . 0.79000000000000004 110.479 178.451 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.459 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 45.5 mmtm -80.12 128.55 73.08 Favored Pre-proline 0 C--N 1.319 -0.74 0 CA-C-N 115.943 -0.571 . . . . 1.6799999999999999 110.51 -178.035 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.459 ' HD3' ' HA ' ' A' ' 7' ' ' LYS . 1.9 Cg_endo -81.32 94.99 0.94 Allowed 'Trans proline' 0 N--CA 1.452 -0.946 0 C-N-CA 122.367 2.045 . . . . 0.72999999999999998 112.132 178.771 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -98.08 -69.1 0.94 Allowed Glycine 0 N--CA 1.446 -0.692 0 N-CA-C 111.071 -0.812 . . . . 0.51000000000000001 111.071 176.758 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -93.64 -20.51 20.12 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 121.717 0.77 . . . . 2.4100000000000001 109.536 173.37 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . 0.413 ' C ' ' H ' ' A' ' 13' ' ' THR . 16.2 m120 -92.69 21.38 5.55 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.043 -0.98 . . . . 2.4900000000000002 109.897 179.691 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -75.79 24.34 0.12 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.6 -0.727 . . . . 0.41999999999999998 112.088 -176.305 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.413 ' H ' ' C ' ' A' ' 11' ' ' ASN . 13.2 p -61.51 149.26 84.44 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 116.057 -0.52 . . . . 0.73999999999999999 110.454 175.711 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -49.27 -35.79 35.61 Favored 'Trans proline' 0 C--N 1.343 0.248 0 C-N-CA 122.921 2.414 . . . . 0.68000000000000005 112.405 -179.474 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 23.7 mm-40 -63.78 -54.15 39.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.988 -0.551 . . . . 2.4399999999999999 111.63 -179.905 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 52.2 tptt -74.48 -34.72 63.19 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.208 0.528 . . . . 1.8 110.162 -176.57 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.508 ' O ' ' HG2' ' A' ' 21' ' ' GLN . 55.9 tp -61.91 -40.89 97.0 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.46 -0.791 . . . . 0.35999999999999999 110.721 179.64 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.17 -40.97 95.01 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.765 0.317 . . . . 0.27000000000000002 110.594 178.522 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 27.9 tptp -64.37 -38.49 91.23 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.135 -0.484 . . . . 2.54 110.042 177.556 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' 0A1 . . . . . 0.537 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.508 ' HG2' ' O ' ' A' ' 17' ' ' LEU . 78.7 mm-40 -60.87 -45.35 94.91 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.999 -0.546 . . . . 1.99 110.965 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.31 -27.82 65.72 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.821 -0.627 . . . . 0.38 111.611 -177.622 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.425 ' HA ' ' HD3' ' A' ' 26' ' ' LYS . 4.8 t70 -82.83 -26.61 31.53 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.138 0.494 . . . . 0.56999999999999995 109.978 -178.54 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.537 ' HG ' ' O ' ' A' ' 20' ' ' 0A1 . 73.0 mt -62.83 -28.37 69.96 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.873 -0.603 . . . . 0.32000000000000001 110.684 175.087 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.14 -26.09 68.12 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.496 0.665 . . . . 0.37 110.455 177.843 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.425 ' HD3' ' HA ' ' A' ' 23' ' ' ASP . 39.3 mtpt -87.38 -53.65 4.71 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.143 -0.935 . . . . 2.48 109.835 176.962 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' 0A1 . . . . . 0.427 ' CE2' ' HB3' ' A' ' 4' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -62.18 -25.19 67.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.566 -0.288 . . . . 0.71999999999999997 111.697 -172.168 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 61.4 tttp -63.39 -65.57 0.66 Allowed 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 116.373 -0.376 . . . . 2.3599999999999999 110.63 179.161 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.408 ' OD1' ' HG3' ' A' ' 2' ' ' PRO . 27.9 t70 -67.04 -30.74 70.9 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.318 -0.401 . . . . 0.93999999999999995 110.634 179.84 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -61.4 -46.62 89.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.213 -0.449 . . . . 1.3300000000000001 110.475 -179.637 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.29 -34.66 78.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.229 -0.441 . . . . 1.0800000000000001 111.12 179.035 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -72.89 -39.19 66.6 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.031 0.443 . . . . 1.46 110.627 179.457 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' 0A1 . . . . . 0.411 HMC2 ' HE2' ' A' ' 34' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.458 0 CA-C-N 116.377 -0.374 . . . . 1.1399999999999999 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.155 . . . . . . . . 1.1699999999999999 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -62.34 163.52 20.26 Favored 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 122.536 2.158 . . . . 0.96999999999999997 111.767 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 14.9 Cg_exo -68.03 177.91 3.96 Favored 'Trans proline' 0 C--O 1.234 0.277 0 C-N-CA 122.29 1.994 . . . . 0.56000000000000005 110.765 173.152 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 7.7 p -57.13 104.64 0.17 Allowed 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 110.232 -0.285 . . . . 0.69999999999999996 110.232 175.612 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.428 ' HA ' ' HD3' ' A' ' 5' ' ' PRO . 46.8 pttt -88.79 135.71 31.77 Favored Pre-proline 0 C--N 1.322 -0.627 0 CA-C-O 120.963 0.411 . . . . 1.96 111.153 -174.328 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 4' ' ' LYS . 31.7 Cg_endo -78.97 141.23 16.55 Favored 'Trans proline' 0 N--CA 1.452 -0.959 0 C-N-CA 122.47 2.113 . . . . 0.44 111.341 -179.578 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 9.0 t -62.76 139.82 58.71 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.085 0.469 . . . . 0.79000000000000004 110.704 -177.882 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 34.6 mmtp -73.18 129.76 85.65 Favored Pre-proline 0 C--N 1.324 -0.532 0 CA-C-N 115.497 -0.774 . . . . 1.6799999999999999 110.358 -177.421 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -75.46 92.21 1.02 Allowed 'Trans proline' 0 N--CA 1.457 -0.622 0 C-N-CA 122.503 2.135 . . . . 0.72999999999999998 112.359 -179.78 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -98.43 -70.44 0.98 Allowed Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 120.819 -0.705 . . . . 0.51000000000000001 111.432 177.142 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -93.41 -24.15 18.16 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-O 121.545 0.688 . . . . 2.4100000000000001 110.22 176.29 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -93.17 22.16 5.32 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.277 -0.874 . . . . 2.4900000000000002 110.092 -178.48 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -75.99 23.82 0.13 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.731 -0.668 . . . . 0.41999999999999998 112.536 -175.222 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 15.5 p -64.41 148.93 95.73 Favored Pre-proline 0 C--N 1.321 -0.641 0 CA-C-N 116.437 -0.347 . . . . 0.73999999999999999 110.305 177.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -51.84 -31.69 43.53 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.677 2.251 . . . . 0.68000000000000005 112.344 -179.836 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -62.4 -45.1 94.64 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.609 -0.723 . . . . 2.4399999999999999 111.096 179.631 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 48.1 tttp -90.8 -34.32 15.36 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.413 -0.358 . . . . 1.8 111.24 -176.725 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.459 ' O ' ' HG2' ' A' ' 21' ' ' GLN . 54.8 tp -59.77 -39.35 84.57 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.259 -0.428 . . . . 0.35999999999999999 111.034 -176.552 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.89 -37.17 85.4 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.743 0.306 . . . . 0.27000000000000002 110.648 177.81 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 27.9 tptp -65.38 -41.14 94.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.205 -0.452 . . . . 2.54 109.919 176.48 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' 0A1 . . . . . 0.482 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.459 ' HG2' ' O ' ' A' ' 17' ' ' LEU . 83.7 mm-40 -62.05 -46.71 87.92 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.128 -0.487 . . . . 1.99 111.016 179.135 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.1 -33.71 76.67 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.929 -0.578 . . . . 0.38 111.234 -179.785 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -74.44 -29.27 61.42 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.14 -0.482 . . . . 0.56999999999999995 110.254 179.688 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.482 ' HG ' ' O ' ' A' ' 20' ' ' 0A1 . 68.4 mt -63.96 -31.23 72.35 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.263 -0.426 . . . . 0.32000000000000001 110.762 176.062 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.52 -26.73 68.71 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.523 0.678 . . . . 0.37 110.159 176.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 59.1 mttm -87.82 -46.69 9.22 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.061 -0.972 . . . . 2.48 109.67 177.189 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 93.9 mt-30 -63.42 -32.44 73.88 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.503 -0.317 . . . . 0.71999999999999997 111.372 -174.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 56.2 tptt -65.64 -53.94 34.43 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-O 120.916 0.389 . . . . 2.3599999999999999 110.419 177.29 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -65.23 -30.75 71.66 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.318 0.58 . . . . 0.93999999999999995 110.291 179.371 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 23.1 tp -62.57 -34.24 76.57 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.498 -0.774 . . . . 1.3300000000000001 110.799 178.519 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.81 -30.75 71.76 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.085 -0.507 . . . . 1.0800000000000001 111.083 178.606 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -72.95 -26.78 61.5 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.094 0.473 . . . . 1.46 110.298 178.148 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.497 0 CA-C-N 116.451 -0.341 . . . . 1.1399999999999999 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.23 . . . . . . . . 1.1699999999999999 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -63.12 155.32 61.86 Favored 'Trans proline' 0 C--O 1.236 0.403 0 C-N-CA 122.411 2.074 . . . . 0.96999999999999997 112.54 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.536 ' HG2' ' CD2' ' A' ' 27' ' ' 0A1 . 37.9 Cg_endo -68.41 175.26 7.12 Favored 'Trans proline' 0 C--O 1.233 0.229 0 C-N-CA 123.1 2.534 . . . . 0.56000000000000005 112.641 -179.5 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 6.5 p -63.74 108.92 1.55 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.909 -0.587 . . . . 0.69999999999999996 111.386 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.455 ' HA ' ' HD3' ' A' ' 5' ' ' PRO . 57.2 pttt -93.58 142.81 25.64 Favored Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 116.476 -0.329 . . . . 1.96 110.814 -179.605 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.455 ' HD3' ' HA ' ' A' ' 4' ' ' LYS . 22.2 Cg_endo -84.52 179.28 4.53 Favored 'Trans proline' 0 N--CA 1.457 -0.674 0 C-N-CA 122.669 2.246 . . . . 0.44 112.683 -176.474 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 9.8 t -93.92 149.83 20.89 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.336 -0.393 . . . . 0.79000000000000004 110.072 177.458 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.478 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 68.4 mmtt -82.25 130.27 60.32 Favored Pre-proline 0 C--N 1.326 -0.425 0 CA-C-O 120.624 0.25 . . . . 1.6799999999999999 110.732 -177.474 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.478 ' HD3' ' HA ' ' A' ' 7' ' ' LYS . 7.2 Cg_exo -72.14 105.75 1.9 Allowed 'Trans proline' 0 C--O 1.235 0.352 0 C-N-CA 122.765 2.31 . . . . 0.72999999999999998 112.602 178.124 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -95.78 -70.98 1.08 Allowed Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.903 -0.665 . . . . 0.51000000000000001 111.623 176.736 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -95.37 -18.19 20.96 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.775 0.798 . . . . 2.4100000000000001 109.649 176.139 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 18.3 m120 -93.33 21.0 6.45 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.028 -0.987 . . . . 2.4900000000000002 109.67 178.879 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -78.09 16.08 0.81 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.479 -0.782 . . . . 0.41999999999999998 111.982 -174.554 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 23.8 p -68.25 153.31 95.69 Favored Pre-proline 0 C--N 1.322 -0.599 0 CA-C-N 116.171 -0.468 . . . . 0.73999999999999999 110.045 174.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_exo -51.29 -22.34 11.4 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 123.023 2.482 . . . . 0.68000000000000005 113.02 -179.351 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -62.63 -62.91 1.42 Allowed 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 116.302 -0.408 . . . . 2.4399999999999999 111.425 178.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -82.96 -27.66 30.35 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.923 0.392 . . . . 1.8 110.691 -177.269 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.536 ' O ' ' HG2' ' A' ' 21' ' ' GLN . 55.7 tp -60.12 -40.65 90.5 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.984 -0.553 . . . . 0.35999999999999999 110.829 179.457 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.8 -36.42 80.4 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.77 0.319 . . . . 0.27000000000000002 110.634 177.148 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -64.48 -40.48 95.75 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.633 -0.506 . . . . 2.54 109.633 176.624 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' 0A1 . . . . . 0.466 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.536 ' HG2' ' O ' ' A' ' 17' ' ' LEU . 85.7 mm-40 -62.66 -43.51 98.62 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.115 -0.493 . . . . 1.99 110.698 177.296 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.95 -36.77 84.55 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.734 -0.666 . . . . 0.38 111.01 178.016 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -68.88 -37.59 79.12 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.726 -0.472 . . . . 0.56999999999999995 109.726 178.673 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 20' ' ' 0A1 . 79.1 mt -63.02 -28.32 70.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.697 -0.683 . . . . 0.32000000000000001 110.979 177.009 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.98 -26.98 69.1 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.226 0.536 . . . . 0.37 110.564 177.258 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 51.8 mtmt -89.27 -51.17 5.71 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.586 -0.733 . . . . 2.48 109.861 176.432 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' 0A1 . . . . . 0.536 ' CD2' ' HG2' ' A' ' 2' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.41 ' HA ' ' HB3' ' A' ' 31' ' ' LEU . 96.7 mt-30 -64.17 -23.83 67.46 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.668 -0.242 . . . . 0.71999999999999997 111.634 -173.202 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 60.6 tttp -63.84 -57.37 10.08 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 121.185 0.517 . . . . 2.3599999999999999 110.06 177.754 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.426 ' HB3' ' HG3' ' A' ' 2' ' ' PRO . 14.1 t70 -67.75 -36.78 81.15 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.489 -0.778 . . . . 0.93999999999999995 110.466 178.522 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.41 ' HB3' ' HA ' ' A' ' 28' ' ' GLN . 3.1 tm? -64.28 -38.39 90.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.399 -0.819 . . . . 1.3300000000000001 110.822 -177.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.0 -30.5 71.49 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.146 0.498 . . . . 1.0800000000000001 110.947 178.393 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -79.26 -37.55 37.65 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.878 -0.601 . . . . 1.46 110.421 178.14 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' 0A1 . . . . . 0.428 ' HE1' HMC3 ' A' ' 34' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.374 0 CA-C-N 116.273 -0.422 . . . . 1.1399999999999999 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.203 . . . . . . . . 1.1699999999999999 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.449 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . 16.9 Cg_exo -65.44 155.23 69.87 Favored 'Trans proline' 0 N--CA 1.461 -0.416 0 C-N-CA 122.497 2.131 . . . . 0.96999999999999997 111.595 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.449 ' HD3' ' HA ' ' A' ' 1' ' ' PRO . 4.6 Cg_exo -72.16 179.51 4.89 Favored 'Trans proline' 0 N--CA 1.46 -0.486 0 C-N-CA 122.533 2.155 . . . . 0.56000000000000005 110.952 176.243 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 11.7 p -62.87 94.7 0.07 Allowed 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.955 0.407 . . . . 0.69999999999999996 110.466 176.458 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.496 ' HA ' ' HD3' ' A' ' 5' ' ' PRO . 6.6 ptmm? -75.33 125.82 88.46 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-N 115.929 -0.578 . . . . 1.96 110.977 -175.617 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.496 ' HD3' ' HA ' ' A' ' 4' ' ' LYS . 2.5 Cg_endo -81.1 166.43 18.64 Favored 'Trans proline' 0 N--CA 1.454 -0.803 0 C-N-CA 122.628 2.219 . . . . 0.44 112.12 -178.064 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.1 t -78.89 138.54 38.17 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.026 -0.534 . . . . 0.79000000000000004 110.565 179.672 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 48.6 mmtm -74.81 128.71 84.84 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-N 115.818 -0.628 . . . . 1.6799999999999999 110.028 177.811 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.412 ' HA ' ' OD1' ' A' ' 11' ' ' ASN . 58.7 Cg_endo -75.3 84.72 1.66 Allowed 'Trans proline' 0 N--CA 1.46 -0.477 0 C-N-CA 122.642 2.228 . . . . 0.72999999999999998 113.201 -176.886 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -101.77 -71.81 0.93 Allowed Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.879 -0.676 . . . . 0.51000000000000001 111.819 174.419 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -94.05 6.44 48.53 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.341 0.591 . . . . 2.4100000000000001 109.809 177.319 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . 0.439 ' HB2' ' HD2' ' A' ' 16' ' ' LYS . 10.2 p30 -126.55 20.51 7.25 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.227 -0.897 . . . . 2.4900000000000002 109.719 -179.503 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -79.43 29.62 0.24 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.129 -0.941 . . . . 0.41999999999999998 113.009 -170.493 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 6.8 p -64.43 143.64 98.52 Favored Pre-proline 0 C--N 1.316 -0.859 0 N-CA-C 109.897 -0.408 . . . . 0.73999999999999999 109.897 175.445 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -50.24 -32.96 34.57 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.834 2.356 . . . . 0.68000000000000005 112.304 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 51.7 mm-40 -63.09 -48.04 80.29 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.739 -0.664 . . . . 2.4399999999999999 111.208 179.209 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.439 ' HD2' ' HB2' ' A' ' 11' ' ' ASN . 3.8 ttmp? -84.03 -32.12 25.05 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.369 -0.378 . . . . 1.8 110.51 -177.526 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.511 ' O ' ' HG3' ' A' ' 21' ' ' GLN . 57.5 tp -59.61 -46.22 89.63 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.983 -0.553 . . . . 0.35999999999999999 110.799 179.258 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.34 -36.84 85.43 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.428 -0.351 . . . . 0.27000000000000002 110.626 177.732 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 57.6 tptt -65.07 -41.27 95.24 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.163 -0.472 . . . . 2.54 110.146 177.04 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' 0A1 . . . . . 0.598 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.511 ' HG3' ' O ' ' A' ' 17' ' ' LEU . 97.5 mt-30 -62.06 -41.02 97.7 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.717 -0.674 . . . . 1.99 110.899 179.467 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.52 -34.9 72.81 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.897 -0.592 . . . . 0.38 110.983 178.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -70.81 -29.88 66.17 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.767 -0.457 . . . . 0.56999999999999995 109.767 179.568 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.598 ' HG ' ' O ' ' A' ' 20' ' ' 0A1 . 71.3 mt -61.36 -28.82 69.5 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.877 -0.601 . . . . 0.32000000000000001 110.593 176.02 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.47 -29.24 70.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.332 0.586 . . . . 0.37 110.572 177.818 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 64.5 mttm -91.24 -47.57 7.43 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.226 -0.897 . . . . 2.48 110.21 177.46 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' 0A1 . . . . . 0.452 HMC2 ' HE2' ' A' ' 27' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.448 ' HA ' ' HB3' ' A' ' 31' ' ' LEU . 97.8 mt-30 -65.38 -21.44 66.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.529 -0.305 . . . . 0.71999999999999997 111.509 -174.757 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -64.76 -57.98 7.48 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-O 121.009 0.433 . . . . 2.3599999999999999 110.078 176.565 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -66.42 -33.31 75.43 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.256 0.55 . . . . 0.93999999999999995 110.093 178.304 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.448 ' HB3' ' HA ' ' A' ' 28' ' ' GLN . 18.6 tp -62.29 -36.27 81.59 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.612 -0.722 . . . . 1.3300000000000001 110.971 179.355 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.93 -36.1 80.39 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.282 -0.417 . . . . 1.0800000000000001 111.009 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -78.04 -33.58 50.95 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.0 0.429 . . . . 1.46 110.145 177.148 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.475 0 CA-C-N 116.59 -0.277 . . . . 1.1399999999999999 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.195 . . . . . . . . 1.1699999999999999 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -65.07 168.07 14.73 Favored 'Trans proline' 0 C--O 1.237 0.45 0 C-N-CA 123.019 2.479 . . . . 0.96999999999999997 112.191 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.411 ' HG2' ' CD2' ' A' ' 27' ' ' 0A1 . 60.9 Cg_endo -78.5 -179.46 5.47 Favored 'Trans proline' 0 C--O 1.235 0.335 0 C-N-CA 122.626 2.218 . . . . 0.56000000000000005 112.251 178.464 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 4.5 p -63.04 97.77 0.12 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.83 -0.623 . . . . 0.69999999999999996 111.999 -178.89 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.421 ' HD3' ' H ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -73.36 128.8 86.82 Favored Pre-proline 0 N--CA 1.448 -0.542 0 CA-C-N 116.137 -0.483 . . . . 1.96 110.192 176.715 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -71.35 158.0 55.4 Favored 'Trans proline' 0 C--O 1.237 0.471 0 C-N-CA 122.542 2.162 . . . . 0.44 112.258 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 10.2 t -64.55 139.89 58.81 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.904 -0.589 . . . . 0.79000000000000004 110.161 178.686 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 43.2 mmtm -81.55 129.41 65.88 Favored Pre-proline 0 C--N 1.321 -0.633 0 CA-C-N 116.093 -0.503 . . . . 1.6799999999999999 110.898 -175.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_endo -77.65 89.97 1.29 Allowed 'Trans proline' 0 N--CA 1.457 -0.65 0 C-N-CA 122.816 2.344 . . . . 0.72999999999999998 112.691 179.796 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -101.45 -70.71 0.89 Allowed Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.831 -0.7 . . . . 0.51000000000000001 111.374 174.5 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -88.96 -25.29 22.13 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 121.525 0.679 . . . . 2.4100000000000001 110.021 176.366 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -96.31 21.56 8.88 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.217 -0.901 . . . . 2.4900000000000002 109.322 -179.999 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -74.29 13.96 0.5 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.49 -0.777 . . . . 0.41999999999999998 112.125 -177.009 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 17.4 p -57.75 151.25 43.26 Favored Pre-proline 0 C--N 1.323 -0.557 0 CA-C-N 116.156 -0.475 . . . . 0.73999999999999999 110.394 175.43 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -58.36 -18.19 37.08 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.71 2.273 . . . . 0.68000000000000005 112.17 -176.605 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -63.14 -57.24 11.24 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.652 -0.704 . . . . 2.4399999999999999 110.204 177.463 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 66.0 tttt -91.13 -23.32 20.32 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.524 -0.762 . . . . 1.8 111.115 -174.625 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.457 ' O ' ' HG3' ' A' ' 21' ' ' GLN . 54.9 tp -59.8 -41.98 92.44 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.268 -0.424 . . . . 0.35999999999999999 110.79 179.833 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.45 -35.67 75.88 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.927 0.394 . . . . 0.27000000000000002 110.63 177.46 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -67.19 -37.49 83.77 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.217 -0.447 . . . . 2.54 109.916 178.707 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' 0A1 . . . . . 0.514 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.457 ' HG3' ' O ' ' A' ' 17' ' ' LEU . 78.2 mt-30 -60.77 -45.12 95.56 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.853 -0.612 . . . . 1.99 110.586 177.013 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.61 -31.02 72.06 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.534 -0.757 . . . . 0.38 111.298 179.865 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -77.13 -33.15 56.82 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.928 0.394 . . . . 0.56999999999999995 109.943 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.514 ' HG ' ' O ' ' A' ' 20' ' ' 0A1 . 71.2 mt -60.61 -29.49 69.25 Favored 'General case' 0 C--O 1.225 -0.211 0 CA-C-N 115.963 -0.562 . . . . 0.32000000000000001 110.639 176.913 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.66 -26.4 68.63 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.185 0.517 . . . . 0.37 110.799 178.138 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt -91.28 -48.55 6.85 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.65 -0.705 . . . . 2.48 110.251 176.255 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' 0A1 . . . . . 0.419 HMC2 ' HE1' ' A' ' 27' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -64.42 -31.36 72.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.512 -0.313 . . . . 0.71999999999999997 110.926 -176.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 19.0 ttmm -61.06 -54.64 42.24 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-O 121.258 0.551 . . . . 2.3599999999999999 110.286 178.88 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -68.14 -36.98 80.57 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.489 -0.778 . . . . 0.93999999999999995 110.377 179.093 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 19.1 tp -62.77 -37.99 88.83 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.918 -0.583 . . . . 1.3300000000000001 110.92 -179.342 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.99 -36.68 85.17 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.056 0.455 . . . . 1.0800000000000001 110.758 176.27 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -71.9 -37.28 70.14 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.818 -0.628 . . . . 1.46 110.334 177.65 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' 0A1 . . . . . 0.427 HMC2 ' HE1' ' A' ' 34' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.555 0 CA-C-N 116.349 -0.387 . . . . 1.1399999999999999 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.256 . . . . . . . . 1.1699999999999999 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -62.49 155.33 58.69 Favored 'Trans proline' 0 C--O 1.237 0.444 0 C-N-CA 122.68 2.253 . . . . 0.96999999999999997 112.542 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.485 ' HG2' ' CD2' ' A' ' 27' ' ' 0A1 . 35.6 Cg_endo -67.71 176.9 4.59 Favored 'Trans proline' 0 C--O 1.235 0.355 0 C-N-CA 122.967 2.445 . . . . 0.56000000000000005 112.718 -179.501 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 39.8 p -66.79 103.01 1.02 Allowed 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.892 -0.595 . . . . 0.69999999999999996 111.129 -179.033 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.487 ' HA ' ' HD3' ' A' ' 5' ' ' PRO . 58.7 pttt -83.48 135.06 44.11 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 116.377 -0.374 . . . . 1.96 110.9 -178.72 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.487 ' HD3' ' HA ' ' A' ' 4' ' ' LYS . 10.0 Cg_exo -71.03 148.28 56.53 Favored 'Trans proline' 0 N--CA 1.46 -0.488 0 C-N-CA 122.508 2.139 . . . . 0.44 112.39 -179.431 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 5.1 t -69.87 136.5 50.75 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.913 -0.585 . . . . 0.79000000000000004 109.799 176.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 44.5 mmtm -69.54 149.7 96.99 Favored Pre-proline 0 C--N 1.324 -0.517 0 CA-C-N 115.596 -0.729 . . . . 1.6799999999999999 112.058 -170.099 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -61.58 65.7 0.1 Allowed 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 123.523 2.815 . . . . 0.72999999999999998 114.053 174.024 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -92.94 -69.83 1.13 Allowed Glycine 0 C--N 1.31 -0.892 0 N-CA-C 109.415 -1.474 . . . . 0.51000000000000001 109.415 166.629 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -97.68 2.1 49.34 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 108.75 -0.833 . . . . 2.4100000000000001 108.75 168.5 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 52.1 m-80 -104.9 19.48 20.48 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.141 -0.936 . . . . 2.4900000000000002 110.005 -179.542 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -95.42 6.37 49.17 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.327 -0.397 . . . . 0.41999999999999998 111.266 -175.662 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 11.8 p -64.3 145.59 98.17 Favored Pre-proline 0 C--N 1.325 -0.487 0 N-CA-C 109.458 -0.571 . . . . 0.73999999999999999 109.458 172.058 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_exo -49.07 -37.17 37.44 Favored 'Trans proline' 0 C--O 1.233 0.244 0 C-N-CA 122.339 2.026 . . . . 0.68000000000000005 112.309 -178.551 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 24.3 mm-40 -68.21 -48.86 64.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.771 -0.649 . . . . 2.4399999999999999 111.56 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 22.1 tptp -82.85 -26.71 31.39 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.057 -0.52 . . . . 1.8 110.81 -174.159 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 48.1 tp -64.15 -41.6 97.11 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.03 -0.532 . . . . 0.35999999999999999 110.269 177.524 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.99 -38.22 87.94 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.886 -0.597 . . . . 0.27000000000000002 110.006 175.803 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 56.2 tptt -65.48 -38.98 91.37 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.723 -0.672 . . . . 2.54 110.38 176.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 74.5 mm-40 -63.01 -46.58 86.93 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.148 -0.478 . . . . 1.99 111.251 178.218 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.49 -38.16 88.81 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.596 -0.729 . . . . 0.38 111.25 179.429 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 28.2 t0 -73.91 -29.44 62.05 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.122 0.487 . . . . 0.56999999999999995 110.158 -179.672 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 30.4 mt -62.62 -32.82 73.92 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 115.99 -0.55 . . . . 0.32000000000000001 110.676 173.795 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.88 -34.09 74.09 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.141 0.496 . . . . 0.37 110.509 -179.719 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -79.33 -46.02 18.49 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.483 -0.78 . . . . 2.48 110.211 177.535 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' 0A1 . . . . . 0.485 ' CD2' ' HG2' ' A' ' 2' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.449 ' HA ' ' HB3' ' A' ' 31' ' ' LEU . 96.7 mt-30 -64.82 -23.9 67.38 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.622 -0.263 . . . . 0.71999999999999997 111.56 -174.801 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 39.6 ttmt -63.06 -58.93 5.62 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 121.081 0.467 . . . . 2.3599999999999999 110.476 177.284 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -68.15 -32.65 73.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.739 -0.664 . . . . 0.93999999999999995 110.244 178.793 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.449 ' HB3' ' HA ' ' A' ' 28' ' ' GLN . 23.0 tp -62.96 -33.29 75.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.677 -0.692 . . . . 1.3300000000000001 111.332 179.534 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.27 -29.3 70.65 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.954 0.406 . . . . 1.0800000000000001 110.844 178.665 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -79.77 -36.86 36.53 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.068 -0.515 . . . . 1.46 109.678 176.312 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' 0A1 . . . . . 0.474 HMC2 ' HE2' ' A' ' 34' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.456 0 CA-C-N 116.582 -0.281 . . . . 1.1399999999999999 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.244 . . . . . . . . 1.1699999999999999 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_exo -66.04 165.16 24.89 Favored 'Trans proline' 0 C--O 1.236 0.423 0 C-N-CA 122.954 2.436 . . . . 0.96999999999999997 112.189 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_exo -64.59 167.77 14.54 Favored 'Trans proline' 0 C--O 1.237 0.448 0 C-N-CA 122.692 2.261 . . . . 0.56000000000000005 111.58 175.211 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 18.2 p -67.22 111.14 3.79 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 109.974 -0.38 . . . . 0.69999999999999996 109.974 176.461 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.405 ' HA ' ' HD3' ' A' ' 5' ' ' PRO . 0.4 OUTLIER -87.57 147.91 42.84 Favored Pre-proline 0 N--CA 1.449 -0.492 0 CA-C-O 120.755 0.312 . . . . 1.96 110.956 -175.747 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 4' ' ' LYS . 3.3 Cg_endo -84.24 167.45 12.21 Favored 'Trans proline' 0 N--CA 1.453 -0.879 0 C-N-CA 122.902 2.401 . . . . 0.44 112.025 -176.694 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 11.1 t -88.69 138.8 31.09 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 109.69 -0.485 . . . . 0.79000000000000004 109.69 176.508 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.481 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 33.2 mmtp -79.16 128.12 76.99 Favored Pre-proline 0 C--N 1.317 -0.845 0 CA-C-N 116.008 -0.542 . . . . 1.6799999999999999 109.805 -178.944 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.481 ' HD3' ' HA ' ' A' ' 7' ' ' LYS . 0.9 OUTLIER -79.12 94.32 1.07 Allowed 'Trans proline' 0 N--CA 1.455 -0.768 0 C-N-CA 122.235 1.957 . . . . 0.72999999999999998 112.48 -178.715 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -101.2 -71.18 0.92 Allowed Glycine 0 N--CA 1.445 -0.745 0 C-N-CA 120.922 -0.656 . . . . 0.51000000000000001 111.48 175.492 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -85.35 -29.48 24.45 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 121.492 0.663 . . . . 2.4100000000000001 110.311 178.054 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . 0.468 ' C ' ' H ' ' A' ' 13' ' ' THR . 18.9 t-20 -95.68 22.35 7.3 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.373 -0.83 . . . . 2.4900000000000002 109.281 179.67 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -71.97 31.71 0.05 Allowed 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.569 0.581 . . . . 0.41999999999999998 112.569 -177.438 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.468 ' H ' ' C ' ' A' ' 11' ' ' ASN . 40.5 p -59.96 151.07 66.74 Favored Pre-proline 0 C--N 1.318 -0.765 0 CA-C-N 115.841 -0.618 . . . . 0.73999999999999999 109.982 174.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_exo -50.75 -34.42 44.23 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.38 2.053 . . . . 0.68000000000000005 111.846 178.338 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -66.59 -56.24 11.64 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.594 -0.73 . . . . 2.4399999999999999 111.523 179.387 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 17.0 tppt? -70.28 -35.41 73.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.238 0.542 . . . . 1.8 110.373 -176.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.637 ' O ' ' HG3' ' A' ' 21' ' ' GLN . 57.7 tp -60.59 -46.81 88.86 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.376 -0.829 . . . . 0.35999999999999999 110.035 177.143 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.42 -37.11 86.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.109 -0.496 . . . . 0.27000000000000002 110.659 178.165 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 29.9 tttm -59.94 -49.8 76.25 Favored 'General case' 0 C--O 1.222 -0.343 0 CA-C-N 116.095 -0.502 . . . . 2.54 109.659 175.817 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' 0A1 . . . . . 0.528 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.637 ' HG3' ' O ' ' A' ' 17' ' ' LEU . 92.5 mt-30 -60.91 -43.9 97.91 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.082 -0.508 . . . . 1.99 111.001 -179.484 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -77.54 -26.25 50.87 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.054 -0.521 . . . . 0.38 111.129 -179.434 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -77.84 -24.3 48.7 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.022 -0.535 . . . . 0.56999999999999995 110.353 -179.001 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.528 ' HG ' ' O ' ' A' ' 20' ' ' 0A1 . 66.9 mt -63.13 -31.11 72.17 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.218 -0.446 . . . . 0.32000000000000001 110.201 173.464 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.45 -19.86 66.12 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.932 -0.576 . . . . 0.37 110.649 176.771 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 30.0 mmmt -90.3 -52.86 4.71 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.603 -0.726 . . . . 2.48 109.578 175.523 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' 0A1 . . . . . 0.425 ' HE2' HMC2 ' A' ' 27' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -65.04 -28.03 69.2 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.555 0.217 . . . . 0.71999999999999997 111.574 -175.599 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 25.2 ttmm -65.27 -54.02 35.52 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-O 120.924 0.392 . . . . 2.3599999999999999 110.419 177.018 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -66.93 -30.89 71.15 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.349 0.595 . . . . 0.93999999999999995 110.112 177.911 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 20.3 tp -63.13 -32.82 74.3 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.399 -0.819 . . . . 1.3300000000000001 111.08 177.938 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.41 -32.27 73.66 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.288 -0.415 . . . . 1.0800000000000001 111.189 178.818 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -80.72 -29.97 36.33 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.383 0.611 . . . . 1.46 109.833 177.513 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.497 0 CA-C-N 116.346 -0.388 . . . . 1.1399999999999999 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.203 . . . . . . . . 1.1699999999999999 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.677 ' HD3' HMC3 ' A' ' 34' ' ' 0A1 . 30.5 Cg_endo -66.87 161.77 40.73 Favored 'Trans proline' 0 C--O 1.234 0.313 0 C-N-CA 122.764 2.309 . . . . 0.96999999999999997 112.27 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.433 ' HG2' ' CD2' ' A' ' 27' ' ' 0A1 . 56.8 Cg_endo -78.18 177.56 8.63 Favored 'Trans proline' 0 N--CA 1.46 -0.448 0 C-N-CA 122.522 2.148 . . . . 0.56000000000000005 111.792 176.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 19.0 p -59.64 110.12 1.06 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.255 -0.43 . . . . 0.69999999999999996 111.261 179.764 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 16.3 ptmt -94.78 131.88 29.63 Favored Pre-proline 0 C--N 1.325 -0.5 0 CA-C-O 120.936 0.398 . . . . 1.96 110.773 -179.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -78.28 144.49 20.69 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 122.256 1.97 . . . . 0.44 111.807 179.688 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 6.0 t -64.27 143.71 57.69 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.978 -0.555 . . . . 0.79000000000000004 111.128 -177.938 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 49.0 mmtm -65.28 128.82 94.13 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 116.006 -0.543 . . . . 1.6799999999999999 110.804 -179.129 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.436 ' O ' ' HB2' ' A' ' 12' ' ' ALA . 73.0 Cg_endo -81.9 92.81 0.97 Allowed 'Trans proline' 0 N--CA 1.456 -0.704 0 C-N-CA 122.416 2.077 . . . . 0.72999999999999998 112.249 175.593 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -100.09 -70.77 0.94 Allowed Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 120.623 -0.798 . . . . 0.51000000000000001 111.594 177.379 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -90.12 -20.79 22.72 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 121.605 0.717 . . . . 2.4100000000000001 110.17 178.156 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 15.4 m120 -99.48 21.2 12.51 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.24 -0.891 . . . . 2.4900000000000002 110.003 -179.842 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.436 ' HB2' ' O ' ' A' ' 8' ' ' PRO . . . -79.64 31.79 0.24 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.903 -0.59 . . . . 0.41999999999999998 112.522 -174.566 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 17.1 p -58.64 150.59 56.53 Favored Pre-proline 0 C--N 1.319 -0.743 0 CA-C-N 116.229 -0.442 . . . . 0.73999999999999999 110.353 175.369 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_exo -50.65 -38.95 56.65 Favored 'Trans proline' 0 C--N 1.343 0.279 0 C-N-CA 122.562 2.174 . . . . 0.68000000000000005 112.197 -179.446 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 37.3 mm-40 -67.99 -42.06 81.37 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 115.941 -0.572 . . . . 2.4399999999999999 111.932 -177.82 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 59.4 tttm -82.99 -28.38 29.73 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.149 0.499 . . . . 1.8 110.252 -178.389 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.463 ' O ' ' HG3' ' A' ' 21' ' ' GLN . 51.1 tp -63.24 -44.31 95.56 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.685 -0.689 . . . . 0.35999999999999999 110.81 178.435 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.94 -36.34 83.09 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.912 0.387 . . . . 0.27000000000000002 110.21 176.46 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -63.36 -39.61 95.0 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.917 -0.583 . . . . 2.54 110.227 175.871 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' 0A1 . . . . . 0.526 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.463 ' HG3' ' O ' ' A' ' 17' ' ' LEU . 76.8 mt-30 -62.67 -42.97 99.9 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.911 -0.586 . . . . 1.99 110.895 177.665 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.19 -36.29 83.14 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.744 -0.662 . . . . 0.38 111.158 179.647 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.492 ' HA ' ' HE2' ' A' ' 26' ' ' LYS . 7.4 t70 -74.87 -31.04 61.51 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.067 0.461 . . . . 0.56999999999999995 109.867 179.118 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.526 ' HG ' ' O ' ' A' ' 20' ' ' 0A1 . 69.2 mt -63.16 -29.95 71.2 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.964 -0.562 . . . . 0.32000000000000001 110.608 174.651 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.75 -28.6 69.55 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.368 0.604 . . . . 0.37 110.701 178.51 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.492 ' HE2' ' HA ' ' A' ' 23' ' ' ASP . 48.7 mtmt -89.84 -46.18 8.74 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.499 -0.773 . . . . 2.48 110.157 176.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' 0A1 . . . . . 0.493 HMC2 ' HE1' ' A' ' 27' ' ' 0A1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 99.1 mt-30 -61.57 -29.1 69.8 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 112.051 0.389 . . . . 0.71999999999999997 112.051 -171.005 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 60.4 tttm -63.22 -59.38 4.82 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 121.051 0.453 . . . . 2.3599999999999999 110.449 179.086 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -68.51 -33.39 74.05 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.961 -0.563 . . . . 0.93999999999999995 110.722 179.818 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -63.7 -34.36 77.68 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.918 -0.583 . . . . 1.3300000000000001 110.184 178.686 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.8 -36.43 83.48 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.171 -0.468 . . . . 1.0800000000000001 111.015 177.167 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -79.42 -21.02 46.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.137 0.494 . . . . 1.46 110.37 179.548 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' 0A1 . . . . . 0.677 HMC3 ' HD3' ' A' ' 1' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.484 0 CA-C-N 116.217 -0.447 . . . . 1.1399999999999999 . . . . . . . . . . 0 0 . 1 stop_ save_