data_2n7o_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 2n7o _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 60.2 m-20 . . . . . 0 CA--C 1.574 1.896 0 CA-C-O 117.938 -1.029 . . . . 73.010000000000005 112.444 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -63.6 138.34 64.12 Favored 'Trans proline' 0 CA--C 1.576 2.603 0 C-N-CA 122.934 2.423 . . . . 72.340000000000003 115.429 -178.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo . . . . . 0 CA--C 1.575 2.565 0 N-CA-C 119.841 2.977 . . . . 73.349999999999994 119.841 12.385 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 . . . . . 0 CA--C 1.56 1.339 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 63.6 t-105 . . . . . 0 CA--C 1.563 1.473 0 CA-C-O 122.386 1.089 . . . . 0.0 111.106 -176.387 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 . . . . . 0 CA--C 1.575 1.928 0 CA-C-O 118.258 -0.877 . . . . 73.010000000000005 112.941 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -67.39 142.29 59.31 Favored 'Trans proline' 0 CA--C 1.574 2.48 0 C-N-CA 123.027 2.485 . . . . 72.340000000000003 116.027 -176.333 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo . . . . . 0 CA--C 1.576 2.579 0 N-CA-C 119.745 2.94 . . . . 73.349999999999994 119.745 9.419 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.4 mmp_? . . . . . 0 N--CA 1.485 1.322 0 CA-C-O 122.231 1.015 . . . . 0.0 110.094 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 67.1 t-105 . . . . . 0 CA--C 1.564 1.49 0 CA-C-O 122.595 1.188 . . . . 0.0 110.994 176.851 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 73.5 m-20 . . . . . 0 CA--C 1.573 1.844 0 CA-C-O 117.871 -1.061 . . . . 73.010000000000005 112.462 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -53.85 138.74 69.27 Favored 'Trans proline' 0 CA--C 1.576 2.581 0 C-N-CA 123.175 2.583 . . . . 72.340000000000003 117.762 173.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo . . . . . 0 CA--C 1.574 2.478 0 N-CA-C 119.263 2.755 . . . . 73.349999999999994 119.263 6.113 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 36.9 ptt180 . . . . . 0 CA--C 1.563 1.466 0 CA-C-O 121.199 0.523 . . . . 0.0 112.186 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 71.4 t-105 . . . . . 0 CA--C 1.562 1.434 0 CA-C-O 122.396 1.093 . . . . 0.0 110.107 171.481 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 37.9 m-20 . . . . . 0 CA--C 1.573 1.864 0 CA-C-O 117.713 -1.137 . . . . 73.010000000000005 112.729 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -67.44 137.92 44.54 Favored 'Trans proline' 0 CA--C 1.574 2.49 0 C-N-CA 123.063 2.509 . . . . 72.340000000000003 116.258 -174.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo . . . . . 0 CA--C 1.574 2.476 0 N-CA-C 119.636 2.898 . . . . 73.349999999999994 119.636 11.688 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 29.2 mtt85 . . . . . 0 CA--C 1.561 1.375 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 69.6 t-105 . . . . . 0 CA--C 1.561 1.381 0 CA-C-O 122.596 1.189 . . . . 0.0 110.69 179.125 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 36.3 m-20 . . . . . 0 CA--C 1.574 1.883 0 CA-C-O 117.728 -1.13 . . . . 73.010000000000005 111.25 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_exo -49.26 133.92 30.53 Favored 'Trans proline' 0 CA--C 1.576 2.62 0 C-N-CA 123.425 2.75 . . . . 72.340000000000003 118.378 176.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo . . . . . 0 CA--C 1.575 2.547 0 CA-C-N 123.057 2.128 . . . . 73.349999999999994 116.055 6.623 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 82.6 mtp180 . . . . . 0 CA--C 1.561 1.399 0 CA-C-O 121.481 0.658 . . . . 0.0 109.724 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 71.0 t-105 . . . . . 0 CA--C 1.561 1.381 0 CA-C-O 122.625 1.202 . . . . 0.0 111.465 -175.257 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 . . . . . 0 CA--C 1.576 1.949 0 CA-C-O 117.756 -1.116 . . . . 73.010000000000005 112.4 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_exo -51.59 140.82 44.54 Favored 'Trans proline' 0 CA--C 1.575 2.534 0 N-CA-C 119.17 2.719 . . . . 72.340000000000003 119.17 179.633 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_exo . . . . . 0 CA--C 1.572 2.422 0 N-CA-C 120.643 3.286 . . . . 73.349999999999994 120.643 0.072 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.8 mpt_? . . . . . 0 CA--C 1.561 1.399 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 66.9 t-105 . . . . . 0 CA--C 1.566 1.57 0 O-C-N 121.125 -0.984 . . . . 0.0 111.602 -179.315 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 54.9 m-20 . . . . . 0 CA--C 1.573 1.831 0 CA-C-O 117.721 -1.133 . . . . 73.010000000000005 112.239 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -67.16 140.75 54.82 Favored 'Trans proline' 0 CA--C 1.575 2.529 0 C-N-CA 122.883 2.389 . . . . 72.340000000000003 115.57 -177.048 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo . . . . . 0 CA--C 1.571 2.359 0 N-CA-C 122.067 3.833 . . . . 73.349999999999994 122.067 9.113 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 . . . . . 0 CA--C 1.561 1.382 0 CA-C-O 121.639 0.733 . . . . 0.0 109.921 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 65.4 t-105 . . . . . 0 CA--C 1.56 1.352 0 CA-C-O 122.388 1.09 . . . . 0.0 110.337 177.399 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 . . . . . 0 CA--C 1.574 1.896 0 CA-C-O 118.55 -0.738 . . . . 73.010000000000005 112.145 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_endo -70.56 148.34 59.7 Favored 'Trans proline' 0 CA--C 1.58 2.776 0 C-N-CA 122.565 2.176 . . . . 72.340000000000003 115.231 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 24.9 Cg_endo . . . . . 0 CA--C 1.574 2.512 0 CA-C-N 122.959 2.093 . . . . 73.349999999999994 115.191 6.02 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 87.7 mmt-85 . . . . . 0 CA--C 1.562 1.42 0 CA-C-O 121.22 0.533 . . . . 0.0 109.698 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 71.5 t-105 . . . . . 0 CA--C 1.564 1.488 0 CA-C-O 122.4 1.095 . . . . 0.0 111.024 -178.328 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 56.9 m-20 . . . . . 0 CA--C 1.574 1.892 0 CA-C-O 118.281 -0.866 . . . . 73.010000000000005 112.889 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -54.3 141.66 70.54 Favored 'Trans proline' 0 CA--C 1.576 2.583 0 C-N-CA 123.333 2.688 . . . . 72.340000000000003 117.786 172.204 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo . . . . . 0 CA--C 1.575 2.527 0 N-CA-C 119.097 2.691 . . . . 73.349999999999994 119.097 4.468 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 28.7 mmm180 . . . . . 0 CA--C 1.561 1.402 0 CA-C-O 121.824 0.821 . . . . 0.0 110.343 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 64.6 t-105 . . . . . 0 CA--C 1.564 1.502 0 CA-C-O 122.617 1.199 . . . . 0.0 110.77 175.356 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 . . . . . 0 CA--C 1.573 1.834 0 CA-C-O 117.713 -1.136 . . . . 73.010000000000005 111.824 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -63.83 135.94 50.8 Favored 'Trans proline' 0 CA--C 1.576 2.592 0 C-N-CA 122.909 2.406 . . . . 72.340000000000003 115.754 -175.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo . . . . . 0 CA--C 1.577 2.657 0 N-CA-C 117.835 2.206 . . . . 73.349999999999994 117.835 10.957 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 78.2 mmt-85 . . . . . 0 CA--C 1.562 1.428 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 66.5 t-105 . . . . . 0 CA--C 1.561 1.378 0 CA-C-O 122.505 1.145 . . . . 0.0 112.165 -170.423 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.224 -0.25 . . . . . . . . 31.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 60.2 m-20 -99.56 134.89 20.81 Favored Pre-proline 0 CA--C 1.574 1.896 0 CA-C-O 117.938 -1.029 . . . . 73.010000000000005 112.444 -170.086 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -63.6 138.34 64.12 Favored 'Trans proline' 0 CA--C 1.576 2.603 0 C-N-CA 122.934 2.423 . . . . 72.340000000000003 115.429 -178.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -85.0 18.72 26.24 Favored 'Cis proline' 0 CA--C 1.575 2.565 0 N-CA-C 119.841 2.977 . . . . 73.349999999999994 119.841 12.385 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' 4J2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -108.98 133.35 53.09 Favored 'General case' 0 CA--C 1.56 1.339 0 C-N-CA 124.924 1.29 . . . . 0.0 108.128 176.364 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 63.6 t-105 -83.67 126.1 32.53 Favored 'General case' 0 CA--C 1.563 1.473 0 CA-C-O 122.386 1.089 . . . . 0.0 111.106 -176.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.9 ttmp? -101.91 -52.15 3.25 Favored 'General case' 0 CA--C 1.564 1.488 0 CA-C-N 114.333 -1.303 . . . . 74.430000000000007 113.876 -170.47 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.574 0 O-C-N 116.946 -3.596 . . . . 71.120000000000005 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.227 -0.08 . . . . . . . . 31.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -98.5 131.06 26.71 Favored Pre-proline 0 CA--C 1.575 1.928 0 CA-C-O 118.258 -0.877 . . . . 73.010000000000005 112.941 -171.216 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -67.39 142.29 59.31 Favored 'Trans proline' 0 CA--C 1.574 2.48 0 C-N-CA 123.027 2.485 . . . . 72.340000000000003 116.027 -176.333 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -84.23 19.18 22.42 Favored 'Cis proline' 0 CA--C 1.576 2.579 0 N-CA-C 119.745 2.94 . . . . 73.349999999999994 119.745 9.419 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' 4J2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.4 mmp_? -95.39 144.23 26.1 Favored 'General case' 0 N--CA 1.485 1.322 0 CA-C-O 122.231 1.015 . . . . 0.0 110.094 158.313 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 67.1 t-105 -79.69 134.79 36.42 Favored 'General case' 0 CA--C 1.564 1.49 0 CA-C-O 122.595 1.188 . . . . 0.0 110.994 176.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -88.76 81.85 6.91 Favored 'General case' 0 CA--C 1.561 1.371 0 CA-C-O 123.604 1.668 . . . . 74.430000000000007 110.336 -179.46 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.316 -0.888 0 O-C-N 117.326 -3.359 . . . . 71.120000000000005 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 -0.015 . . . . . . . . 31.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 73.5 m-20 -115.68 132.15 23.3 Favored Pre-proline 0 CA--C 1.573 1.844 0 CA-C-O 117.871 -1.061 . . . . 73.010000000000005 112.462 -169.215 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -53.85 138.74 69.27 Favored 'Trans proline' 0 CA--C 1.576 2.581 0 C-N-CA 123.175 2.583 . . . . 72.340000000000003 117.762 173.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -82.68 18.61 18.84 Favored 'Cis proline' 0 CA--C 1.574 2.478 0 N-CA-C 119.263 2.755 . . . . 73.349999999999994 119.263 6.113 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' 4J2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 36.9 ptt180 -90.11 148.31 23.08 Favored 'General case' 0 CA--C 1.563 1.466 0 C-N-CA 123.343 0.657 . . . . 0.0 112.186 161.479 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 71.4 t-105 -106.32 124.97 50.41 Favored 'General case' 0 CA--C 1.562 1.434 0 CA-C-O 122.396 1.093 . . . . 0.0 110.107 171.481 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 19.4 pttm -124.45 72.26 1.19 Allowed 'General case' 0 CA--C 1.565 1.532 0 CA-C-O 123.752 1.739 . . . . 74.430000000000007 111.1 175.469 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.32 -0.705 0 O-C-N 116.656 -3.778 . . . . 71.120000000000005 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 -0.017 . . . . . . . . 31.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 37.9 m-20 -113.59 128.07 26.12 Favored Pre-proline 0 CA--C 1.573 1.864 0 CA-C-O 117.713 -1.137 . . . . 73.010000000000005 112.729 -168.054 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -67.44 137.92 44.54 Favored 'Trans proline' 0 CA--C 1.574 2.49 0 C-N-CA 123.063 2.509 . . . . 72.340000000000003 116.258 -174.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -86.51 20.78 24.92 Favored 'Cis proline' 0 CA--C 1.574 2.476 0 N-CA-C 119.636 2.898 . . . . 73.349999999999994 119.636 11.688 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' 4J2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 29.2 mtt85 -94.26 129.69 40.81 Favored 'General case' 0 CA--C 1.561 1.375 0 C-N-CA 124.013 0.925 . . . . 0.0 108.983 168.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 69.6 t-105 -98.38 125.66 43.61 Favored 'General case' 0 CA--C 1.561 1.381 0 CA-C-O 122.596 1.189 . . . . 0.0 110.69 179.125 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.3 pttm -130.96 65.15 1.56 Allowed 'General case' 0 CA--C 1.565 1.548 0 CA-C-O 123.539 1.638 . . . . 74.430000000000007 111.735 178.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.321 -0.663 0 O-C-N 116.666 -3.771 . . . . 71.120000000000005 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 -0.004 . . . . . . . . 31.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 36.3 m-20 -108.45 128.17 26.11 Favored Pre-proline 0 CA--C 1.574 1.883 0 CA-C-O 117.728 -1.13 . . . . 73.010000000000005 111.25 175.23 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_exo -49.26 133.92 30.53 Favored 'Trans proline' 0 CA--C 1.576 2.62 0 C-N-CA 123.425 2.75 . . . . 72.340000000000003 118.378 176.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo -92.23 57.98 0.56 Allowed 'Cis proline' 0 CA--C 1.575 2.547 0 CA-C-N 123.057 2.128 . . . . 73.349999999999994 116.055 6.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' 4J2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 82.6 mtp180 -90.89 134.51 34.41 Favored 'General case' 0 CA--C 1.561 1.399 0 C-N-CA 123.982 0.913 . . . . 0.0 109.724 163.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 71.0 t-105 -101.45 125.64 48.12 Favored 'General case' 0 CA--C 1.561 1.381 0 CA-C-O 122.625 1.202 . . . . 0.0 111.465 -175.257 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.0 pttm -125.07 76.37 1.53 Allowed 'General case' 0 CA--C 1.565 1.52 0 CA-C-O 123.672 1.701 . . . . 74.430000000000007 110.81 173.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.319 -0.739 0 O-C-N 116.85 -3.656 . . . . 71.120000000000005 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.13 . . . . . . . . 31.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -108.46 131.14 21.96 Favored Pre-proline 0 CA--C 1.576 1.949 0 CA-C-O 117.756 -1.116 . . . . 73.010000000000005 112.4 -174.489 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_exo -51.59 140.82 44.54 Favored 'Trans proline' 0 CA--C 1.575 2.534 0 N-CA-C 119.17 2.719 . . . . 72.340000000000003 119.17 179.633 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_exo -73.39 8.11 7.18 Favored 'Cis proline' 0 CA--C 1.572 2.422 0 N-CA-C 120.643 3.286 . . . . 73.349999999999994 120.643 0.072 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' 4J2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.8 mpt_? -92.44 131.7 37.38 Favored 'General case' 0 CA--C 1.561 1.399 0 C-N-CA 123.849 0.86 . . . . 0.0 109.371 165.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 66.9 t-105 -83.72 136.27 34.24 Favored 'General case' 0 CA--C 1.566 1.57 0 O-C-N 121.125 -0.984 . . . . 0.0 111.602 -179.315 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 44.1 mmtm -74.02 -51.34 16.18 Favored 'General case' 0 N--CA 1.491 1.602 0 N-CA-C 115.405 1.631 . . . . 74.430000000000007 115.405 -179.015 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.321 -0.67 0 O-C-N 117.074 -3.517 . . . . 71.120000000000005 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.068 . . . . . . . . 31.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 54.9 m-20 -120.38 125.1 27.37 Favored Pre-proline 0 CA--C 1.573 1.831 0 CA-C-O 117.721 -1.133 . . . . 73.010000000000005 112.239 -164.294 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -67.16 140.75 54.82 Favored 'Trans proline' 0 CA--C 1.575 2.529 0 C-N-CA 122.883 2.389 . . . . 72.340000000000003 115.57 -177.048 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -74.77 5.09 12.22 Favored 'Cis proline' 0 CA--C 1.571 2.359 0 N-CA-C 122.067 3.833 . . . . 73.349999999999994 122.067 9.113 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' 4J2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -95.82 139.23 32.34 Favored 'General case' 0 CA--C 1.561 1.382 0 C-N-CA 123.694 0.798 . . . . 0.0 109.921 163.328 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 65.4 t-105 -98.05 126.72 43.62 Favored 'General case' 0 CA--C 1.56 1.352 0 CA-C-O 122.388 1.09 . . . . 0.0 110.337 177.399 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 34.4 mtmm -100.15 -50.35 4.0 Favored 'General case' 0 CA--C 1.564 1.513 0 CA-C-N 114.402 -1.272 . . . . 74.430000000000007 112.696 169.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.539 0 O-C-N 116.884 -3.635 . . . . 71.120000000000005 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.06 . . . . . . . . 31.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -121.19 138.78 28.43 Favored Pre-proline 0 CA--C 1.574 1.896 0 C-N-CA 124.452 1.101 . . . . 73.010000000000005 112.145 -168.323 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_endo -70.56 148.34 59.7 Favored 'Trans proline' 0 CA--C 1.58 2.776 0 C-N-CA 122.565 2.176 . . . . 72.340000000000003 115.231 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 24.9 Cg_endo -99.43 62.68 0.52 Allowed 'Cis proline' 0 CA--C 1.574 2.512 0 CA-C-N 122.959 2.093 . . . . 73.349999999999994 115.191 6.02 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' 4J2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 87.7 mmt-85 -136.69 145.64 44.97 Favored 'General case' 0 CA--C 1.562 1.42 0 C-N-CA 124.013 0.925 . . . . 0.0 109.698 -172.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 71.5 t-105 -121.58 126.74 49.84 Favored 'General case' 0 CA--C 1.564 1.488 0 CA-C-O 122.4 1.095 . . . . 0.0 111.024 -178.328 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 29.5 mtmm -94.33 88.76 5.66 Favored 'General case' 0 CA--C 1.562 1.416 0 CA-C-O 123.453 1.597 . . . . 74.430000000000007 110.053 172.211 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.318 -0.776 0 O-C-N 117.245 -3.41 . . . . 71.120000000000005 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 -0.01 . . . . . . . . 31.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 56.9 m-20 -117.25 132.56 23.45 Favored Pre-proline 0 CA--C 1.574 1.892 0 CA-C-O 118.281 -0.866 . . . . 73.010000000000005 112.889 -169.802 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -54.3 141.66 70.54 Favored 'Trans proline' 0 CA--C 1.576 2.583 0 C-N-CA 123.333 2.688 . . . . 72.340000000000003 117.786 172.204 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -81.77 17.65 18.24 Favored 'Cis proline' 0 CA--C 1.575 2.527 0 N-CA-C 119.097 2.691 . . . . 73.349999999999994 119.097 4.468 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' 4J2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 28.7 mmm180 -105.0 148.69 26.46 Favored 'General case' 0 CA--C 1.561 1.402 0 C-N-CA 123.891 0.876 . . . . 0.0 110.343 162.767 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 64.6 t-105 -85.17 132.56 34.27 Favored 'General case' 0 CA--C 1.564 1.502 0 CA-C-O 122.617 1.199 . . . . 0.0 110.77 175.356 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.8 ttmp? -106.85 -52.9 2.7 Favored 'General case' 0 CA--C 1.564 1.514 0 CA-C-N 114.256 -1.338 . . . . 74.430000000000007 112.705 -178.195 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.538 0 O-C-N 117.065 -3.522 . . . . 71.120000000000005 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.097 . . . . . . . . 31.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 -105.16 133.39 20.18 Favored Pre-proline 0 CA--C 1.573 1.834 0 CA-C-O 117.713 -1.136 . . . . 73.010000000000005 111.824 -177.32 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -63.83 135.94 50.8 Favored 'Trans proline' 0 CA--C 1.576 2.592 0 C-N-CA 122.909 2.406 . . . . 72.340000000000003 115.754 -175.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -91.78 45.81 1.84 Allowed 'Cis proline' 0 CA--C 1.577 2.657 0 N-CA-C 117.835 2.206 . . . . 73.349999999999994 117.835 10.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' 4J2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 78.2 mmt-85 -117.08 135.04 54.03 Favored 'General case' 0 CA--C 1.562 1.428 0 C-N-CA 124.505 1.122 . . . . 0.0 108.691 173.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 66.5 t-105 -93.79 127.94 39.78 Favored 'General case' 0 CA--C 1.561 1.378 0 CA-C-O 122.505 1.145 . . . . 0.0 112.165 -170.423 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 34.6 mtmm -102.2 -56.74 2.2 Favored 'General case' 0 CA--C 1.564 1.508 0 CA-C-N 114.029 -1.441 . . . . 74.430000000000007 111.694 166.531 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.501 0 O-C-N 117.117 -3.489 . . . . 71.120000000000005 . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 60.2 m-20 . . . . . 0 CA--C 1.574 1.896 0 CA-C-O 117.938 -1.029 . . . . 73.010000000000005 112.444 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -63.6 138.34 64.12 Favored 'Trans proline' 0 CA--C 1.576 2.603 0 C-N-CA 122.934 2.423 . . . . 64.040000000000006 115.429 -178.941 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo . . . . . 0 CA--C 1.575 2.565 0 N-CA-C 119.841 2.977 . . . . 73.349999999999994 119.841 12.385 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 . . . . . 0 CA--C 1.56 1.339 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 63.6 t-105 . . . . . 0 CA--C 1.563 1.473 0 CA-C-O 122.386 1.089 . . . . 0.0 111.106 -176.387 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 . . . . . 0 CA--C 1.575 1.928 0 CA-C-O 118.258 -0.877 . . . . 73.010000000000005 112.941 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -67.39 142.29 59.31 Favored 'Trans proline' 0 CA--C 1.574 2.48 0 C-N-CA 123.027 2.485 . . . . 64.040000000000006 116.027 -176.333 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo . . . . . 0 CA--C 1.576 2.579 0 N-CA-C 119.745 2.94 . . . . 73.349999999999994 119.745 9.419 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.4 mmp_? . . . . . 0 N--CA 1.485 1.322 0 CA-C-O 122.231 1.015 . . . . 0.0 110.094 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 67.1 t-105 . . . . . 0 CA--C 1.564 1.49 0 CA-C-O 122.595 1.188 . . . . 0.0 110.994 176.851 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 73.5 m-20 . . . . . 0 CA--C 1.573 1.844 0 CA-C-O 117.871 -1.061 . . . . 73.010000000000005 112.462 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -53.85 138.74 69.27 Favored 'Trans proline' 0 CA--C 1.576 2.581 0 C-N-CA 123.175 2.583 . . . . 64.040000000000006 117.762 173.918 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo . . . . . 0 CA--C 1.574 2.478 0 N-CA-C 119.263 2.755 . . . . 73.349999999999994 119.263 6.113 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 36.9 ptt180 . . . . . 0 CA--C 1.563 1.466 0 CA-C-O 121.199 0.523 . . . . 0.0 112.186 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 71.4 t-105 . . . . . 0 CA--C 1.562 1.434 0 CA-C-O 122.396 1.093 . . . . 0.0 110.107 171.481 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 37.9 m-20 . . . . . 0 CA--C 1.573 1.864 0 CA-C-O 117.713 -1.137 . . . . 73.010000000000005 112.729 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -67.44 137.92 44.54 Favored 'Trans proline' 0 CA--C 1.574 2.49 0 C-N-CA 123.063 2.509 . . . . 64.040000000000006 116.258 -174.76 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo . . . . . 0 CA--C 1.574 2.476 0 N-CA-C 119.636 2.898 . . . . 73.349999999999994 119.636 11.688 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 29.2 mtt85 . . . . . 0 CA--C 1.561 1.375 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 69.6 t-105 . . . . . 0 CA--C 1.561 1.381 0 CA-C-O 122.596 1.189 . . . . 0.0 110.69 179.125 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 36.3 m-20 . . . . . 0 CA--C 1.574 1.883 0 CA-C-O 117.728 -1.13 . . . . 73.010000000000005 111.25 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_exo -49.26 133.92 30.53 Favored 'Trans proline' 0 CA--C 1.576 2.62 0 C-N-CA 123.425 2.75 . . . . 64.040000000000006 118.378 176.97 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo . . . . . 0 CA--C 1.575 2.547 0 CA-C-N 123.057 2.128 . . . . 73.349999999999994 116.055 6.623 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 82.6 mtp180 . . . . . 0 CA--C 1.561 1.399 0 CA-C-O 121.481 0.658 . . . . 0.0 109.724 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 71.0 t-105 . . . . . 0 CA--C 1.561 1.381 0 CA-C-O 122.625 1.202 . . . . 0.0 111.465 -175.257 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 . . . . . 0 CA--C 1.576 1.949 0 CA-C-O 117.756 -1.116 . . . . 73.010000000000005 112.4 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_exo -51.59 140.82 44.54 Favored 'Trans proline' 0 CA--C 1.575 2.534 0 N-CA-C 119.17 2.719 . . . . 64.040000000000006 119.17 179.633 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_exo . . . . . 0 CA--C 1.572 2.422 0 N-CA-C 120.643 3.286 . . . . 73.349999999999994 120.643 0.072 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.8 mpt_? . . . . . 0 CA--C 1.561 1.399 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 66.9 t-105 . . . . . 0 CA--C 1.566 1.57 0 O-C-N 121.125 -0.984 . . . . 0.0 111.602 -179.315 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 54.9 m-20 . . . . . 0 CA--C 1.573 1.831 0 CA-C-O 117.721 -1.133 . . . . 73.010000000000005 112.239 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -67.16 140.75 54.82 Favored 'Trans proline' 0 CA--C 1.575 2.529 0 C-N-CA 122.883 2.389 . . . . 64.040000000000006 115.57 -177.048 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo . . . . . 0 CA--C 1.571 2.359 0 N-CA-C 122.067 3.833 . . . . 73.349999999999994 122.067 9.113 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 . . . . . 0 CA--C 1.561 1.382 0 CA-C-O 121.639 0.733 . . . . 0.0 109.921 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 65.4 t-105 . . . . . 0 CA--C 1.56 1.352 0 CA-C-O 122.388 1.09 . . . . 0.0 110.337 177.399 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 . . . . . 0 CA--C 1.574 1.896 0 CA-C-O 118.55 -0.738 . . . . 73.010000000000005 112.145 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_endo -70.56 148.34 59.7 Favored 'Trans proline' 0 CA--C 1.58 2.776 0 C-N-CA 122.565 2.176 . . . . 64.040000000000006 115.231 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 24.9 Cg_endo . . . . . 0 CA--C 1.574 2.512 0 CA-C-N 122.959 2.093 . . . . 73.349999999999994 115.191 6.02 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 87.7 mmt-85 . . . . . 0 CA--C 1.562 1.42 0 CA-C-O 121.22 0.533 . . . . 0.0 109.698 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 71.5 t-105 . . . . . 0 CA--C 1.564 1.488 0 CA-C-O 122.4 1.095 . . . . 0.0 111.024 -178.328 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 56.9 m-20 . . . . . 0 CA--C 1.574 1.892 0 CA-C-O 118.281 -0.866 . . . . 73.010000000000005 112.889 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -54.3 141.66 70.54 Favored 'Trans proline' 0 CA--C 1.576 2.583 0 C-N-CA 123.333 2.688 . . . . 64.040000000000006 117.786 172.204 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo . . . . . 0 CA--C 1.575 2.527 0 N-CA-C 119.097 2.691 . . . . 73.349999999999994 119.097 4.468 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 28.7 mmm180 . . . . . 0 CA--C 1.561 1.402 0 CA-C-O 121.824 0.821 . . . . 0.0 110.343 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 64.6 t-105 . . . . . 0 CA--C 1.564 1.502 0 CA-C-O 122.617 1.199 . . . . 0.0 110.77 175.356 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 . . . . . 0 CA--C 1.573 1.834 0 CA-C-O 117.713 -1.136 . . . . 73.010000000000005 111.824 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -63.83 135.94 50.8 Favored 'Trans proline' 0 CA--C 1.576 2.592 0 C-N-CA 122.909 2.406 . . . . 64.040000000000006 115.754 -175.969 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo . . . . . 0 CA--C 1.577 2.657 0 N-CA-C 117.835 2.206 . . . . 73.349999999999994 117.835 10.957 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 78.2 mmt-85 . . . . . 0 CA--C 1.562 1.428 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 66.5 t-105 . . . . . 0 CA--C 1.561 1.378 0 CA-C-O 122.505 1.145 . . . . 0.0 112.165 -170.423 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.224 -0.25 . . . . . . . . 25.23 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 4' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 60.2 m-20 -99.56 134.89 20.81 Favored Pre-proline 0 CA--C 1.574 1.896 0 CA-C-O 117.938 -1.029 . . . . 73.010000000000005 112.444 -170.086 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -63.6 138.34 64.12 Favored 'Trans proline' 0 CA--C 1.576 2.603 0 C-N-CA 122.934 2.423 . . . . 64.040000000000006 115.429 -178.941 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -85.0 18.72 26.24 Favored 'Cis proline' 0 CA--C 1.575 2.565 0 N-CA-C 119.841 2.977 . . . . 73.349999999999994 119.841 12.385 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' 4J2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -108.98 133.35 53.09 Favored 'General case' 0 CA--C 1.56 1.339 0 C-N-CA 124.924 1.29 . . . . 0.0 108.128 176.364 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 63.6 t-105 -83.67 126.1 32.53 Favored 'General case' 0 CA--C 1.563 1.473 0 CA-C-O 122.386 1.089 . . . . 0.0 111.106 -176.387 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.9 ttmp? -101.91 -52.15 3.25 Favored 'General case' 0 CA--C 1.564 1.488 0 CA-C-N 114.333 -1.303 . . . . 74.430000000000007 113.876 -170.47 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.574 0 O-C-N 116.946 -3.596 . . . . 24.350000000000001 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.227 -0.08 . . . . . . . . 25.23 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 4' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -98.5 131.06 26.71 Favored Pre-proline 0 CA--C 1.575 1.928 0 CA-C-O 118.258 -0.877 . . . . 73.010000000000005 112.941 -171.216 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -67.39 142.29 59.31 Favored 'Trans proline' 0 CA--C 1.574 2.48 0 C-N-CA 123.027 2.485 . . . . 64.040000000000006 116.027 -176.333 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -84.23 19.18 22.42 Favored 'Cis proline' 0 CA--C 1.576 2.579 0 N-CA-C 119.745 2.94 . . . . 73.349999999999994 119.745 9.419 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' 4J2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.4 mmp_? -95.39 144.23 26.1 Favored 'General case' 0 N--CA 1.485 1.322 0 CA-C-O 122.231 1.015 . . . . 0.0 110.094 158.313 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 67.1 t-105 -79.69 134.79 36.42 Favored 'General case' 0 CA--C 1.564 1.49 0 CA-C-O 122.595 1.188 . . . . 0.0 110.994 176.851 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -88.76 81.85 6.91 Favored 'General case' 0 CA--C 1.561 1.371 0 CA-C-O 123.604 1.668 . . . . 74.430000000000007 110.336 -179.46 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.316 -0.888 0 O-C-N 117.326 -3.359 . . . . 24.350000000000001 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 -0.015 . . . . . . . . 25.23 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 4' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 73.5 m-20 -115.68 132.15 23.3 Favored Pre-proline 0 CA--C 1.573 1.844 0 CA-C-O 117.871 -1.061 . . . . 73.010000000000005 112.462 -169.215 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -53.85 138.74 69.27 Favored 'Trans proline' 0 CA--C 1.576 2.581 0 C-N-CA 123.175 2.583 . . . . 64.040000000000006 117.762 173.918 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -82.68 18.61 18.84 Favored 'Cis proline' 0 CA--C 1.574 2.478 0 N-CA-C 119.263 2.755 . . . . 73.349999999999994 119.263 6.113 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' 4J2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 36.9 ptt180 -90.11 148.31 23.08 Favored 'General case' 0 CA--C 1.563 1.466 0 C-N-CA 123.343 0.657 . . . . 0.0 112.186 161.479 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 71.4 t-105 -106.32 124.97 50.41 Favored 'General case' 0 CA--C 1.562 1.434 0 CA-C-O 122.396 1.093 . . . . 0.0 110.107 171.481 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 19.4 pttm -124.45 72.26 1.19 Allowed 'General case' 0 CA--C 1.565 1.532 0 CA-C-O 123.752 1.739 . . . . 74.430000000000007 111.1 175.469 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.32 -0.705 0 O-C-N 116.656 -3.778 . . . . 24.350000000000001 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 -0.017 . . . . . . . . 25.23 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 4' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 37.9 m-20 -113.59 128.07 26.12 Favored Pre-proline 0 CA--C 1.573 1.864 0 CA-C-O 117.713 -1.137 . . . . 73.010000000000005 112.729 -168.054 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -67.44 137.92 44.54 Favored 'Trans proline' 0 CA--C 1.574 2.49 0 C-N-CA 123.063 2.509 . . . . 64.040000000000006 116.258 -174.76 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -86.51 20.78 24.92 Favored 'Cis proline' 0 CA--C 1.574 2.476 0 N-CA-C 119.636 2.898 . . . . 73.349999999999994 119.636 11.688 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' 4J2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 29.2 mtt85 -94.26 129.69 40.81 Favored 'General case' 0 CA--C 1.561 1.375 0 C-N-CA 124.013 0.925 . . . . 0.0 108.983 168.724 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 69.6 t-105 -98.38 125.66 43.61 Favored 'General case' 0 CA--C 1.561 1.381 0 CA-C-O 122.596 1.189 . . . . 0.0 110.69 179.125 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.3 pttm -130.96 65.15 1.56 Allowed 'General case' 0 CA--C 1.565 1.548 0 CA-C-O 123.539 1.638 . . . . 74.430000000000007 111.735 178.701 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.321 -0.663 0 O-C-N 116.666 -3.771 . . . . 24.350000000000001 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 -0.004 . . . . . . . . 25.23 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 4' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 36.3 m-20 -108.45 128.17 26.11 Favored Pre-proline 0 CA--C 1.574 1.883 0 CA-C-O 117.728 -1.13 . . . . 73.010000000000005 111.25 175.23 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_exo -49.26 133.92 30.53 Favored 'Trans proline' 0 CA--C 1.576 2.62 0 C-N-CA 123.425 2.75 . . . . 64.040000000000006 118.378 176.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo -92.23 57.98 0.56 Allowed 'Cis proline' 0 CA--C 1.575 2.547 0 CA-C-N 123.057 2.128 . . . . 73.349999999999994 116.055 6.623 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' 4J2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 82.6 mtp180 -90.89 134.51 34.41 Favored 'General case' 0 CA--C 1.561 1.399 0 C-N-CA 123.982 0.913 . . . . 0.0 109.724 163.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 71.0 t-105 -101.45 125.64 48.12 Favored 'General case' 0 CA--C 1.561 1.381 0 CA-C-O 122.625 1.202 . . . . 0.0 111.465 -175.257 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.0 pttm -125.07 76.37 1.53 Allowed 'General case' 0 CA--C 1.565 1.52 0 CA-C-O 123.672 1.701 . . . . 74.430000000000007 110.81 173.745 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.319 -0.739 0 O-C-N 116.85 -3.656 . . . . 24.350000000000001 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.13 . . . . . . . . 25.23 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 4' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -108.46 131.14 21.96 Favored Pre-proline 0 CA--C 1.576 1.949 0 CA-C-O 117.756 -1.116 . . . . 73.010000000000005 112.4 -174.489 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_exo -51.59 140.82 44.54 Favored 'Trans proline' 0 CA--C 1.575 2.534 0 N-CA-C 119.17 2.719 . . . . 64.040000000000006 119.17 179.633 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_exo -73.39 8.11 7.18 Favored 'Cis proline' 0 CA--C 1.572 2.422 0 N-CA-C 120.643 3.286 . . . . 73.349999999999994 120.643 0.072 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' 4J2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.8 mpt_? -92.44 131.7 37.38 Favored 'General case' 0 CA--C 1.561 1.399 0 C-N-CA 123.849 0.86 . . . . 0.0 109.371 165.594 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 66.9 t-105 -83.72 136.27 34.24 Favored 'General case' 0 CA--C 1.566 1.57 0 O-C-N 121.125 -0.984 . . . . 0.0 111.602 -179.315 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 44.1 mmtm -74.02 -51.34 16.18 Favored 'General case' 0 N--CA 1.491 1.602 0 N-CA-C 115.405 1.631 . . . . 74.430000000000007 115.405 -179.015 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.321 -0.67 0 O-C-N 117.074 -3.517 . . . . 24.350000000000001 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.068 . . . . . . . . 25.23 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 4' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 54.9 m-20 -120.38 125.1 27.37 Favored Pre-proline 0 CA--C 1.573 1.831 0 CA-C-O 117.721 -1.133 . . . . 73.010000000000005 112.239 -164.294 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -67.16 140.75 54.82 Favored 'Trans proline' 0 CA--C 1.575 2.529 0 C-N-CA 122.883 2.389 . . . . 64.040000000000006 115.57 -177.048 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -74.77 5.09 12.22 Favored 'Cis proline' 0 CA--C 1.571 2.359 0 N-CA-C 122.067 3.833 . . . . 73.349999999999994 122.067 9.113 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' 4J2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -95.82 139.23 32.34 Favored 'General case' 0 CA--C 1.561 1.382 0 C-N-CA 123.694 0.798 . . . . 0.0 109.921 163.328 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 65.4 t-105 -98.05 126.72 43.62 Favored 'General case' 0 CA--C 1.56 1.352 0 CA-C-O 122.388 1.09 . . . . 0.0 110.337 177.399 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 34.4 mtmm -100.15 -50.35 4.0 Favored 'General case' 0 CA--C 1.564 1.513 0 CA-C-N 114.402 -1.272 . . . . 74.430000000000007 112.696 169.582 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.539 0 O-C-N 116.884 -3.635 . . . . 24.350000000000001 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.06 . . . . . . . . 25.23 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 4' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -121.19 138.78 28.43 Favored Pre-proline 0 CA--C 1.574 1.896 0 C-N-CA 124.452 1.101 . . . . 73.010000000000005 112.145 -168.323 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_endo -70.56 148.34 59.7 Favored 'Trans proline' 0 CA--C 1.58 2.776 0 C-N-CA 122.565 2.176 . . . . 64.040000000000006 115.231 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 24.9 Cg_endo -99.43 62.68 0.52 Allowed 'Cis proline' 0 CA--C 1.574 2.512 0 CA-C-N 122.959 2.093 . . . . 73.349999999999994 115.191 6.02 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' 4J2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 87.7 mmt-85 -136.69 145.64 44.97 Favored 'General case' 0 CA--C 1.562 1.42 0 C-N-CA 124.013 0.925 . . . . 0.0 109.698 -172.709 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 71.5 t-105 -121.58 126.74 49.84 Favored 'General case' 0 CA--C 1.564 1.488 0 CA-C-O 122.4 1.095 . . . . 0.0 111.024 -178.328 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 29.5 mtmm -94.33 88.76 5.66 Favored 'General case' 0 CA--C 1.562 1.416 0 CA-C-O 123.453 1.597 . . . . 74.430000000000007 110.053 172.211 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.318 -0.776 0 O-C-N 117.245 -3.41 . . . . 24.350000000000001 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 -0.01 . . . . . . . . 25.23 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 4' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 56.9 m-20 -117.25 132.56 23.45 Favored Pre-proline 0 CA--C 1.574 1.892 0 CA-C-O 118.281 -0.866 . . . . 73.010000000000005 112.889 -169.802 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -54.3 141.66 70.54 Favored 'Trans proline' 0 CA--C 1.576 2.583 0 C-N-CA 123.333 2.688 . . . . 64.040000000000006 117.786 172.204 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -81.77 17.65 18.24 Favored 'Cis proline' 0 CA--C 1.575 2.527 0 N-CA-C 119.097 2.691 . . . . 73.349999999999994 119.097 4.468 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' 4J2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 28.7 mmm180 -105.0 148.69 26.46 Favored 'General case' 0 CA--C 1.561 1.402 0 C-N-CA 123.891 0.876 . . . . 0.0 110.343 162.767 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 64.6 t-105 -85.17 132.56 34.27 Favored 'General case' 0 CA--C 1.564 1.502 0 CA-C-O 122.617 1.199 . . . . 0.0 110.77 175.356 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.8 ttmp? -106.85 -52.9 2.7 Favored 'General case' 0 CA--C 1.564 1.514 0 CA-C-N 114.256 -1.338 . . . . 74.430000000000007 112.705 -178.195 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.538 0 O-C-N 117.065 -3.522 . . . . 24.350000000000001 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.097 . . . . . . . . 25.23 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 4' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 -105.16 133.39 20.18 Favored Pre-proline 0 CA--C 1.573 1.834 0 CA-C-O 117.713 -1.136 . . . . 73.010000000000005 111.824 -177.32 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -63.83 135.94 50.8 Favored 'Trans proline' 0 CA--C 1.576 2.592 0 C-N-CA 122.909 2.406 . . . . 64.040000000000006 115.754 -175.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -91.78 45.81 1.84 Allowed 'Cis proline' 0 CA--C 1.577 2.657 0 N-CA-C 117.835 2.206 . . . . 73.349999999999994 117.835 10.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' 4J2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 78.2 mmt-85 -117.08 135.04 54.03 Favored 'General case' 0 CA--C 1.562 1.428 0 C-N-CA 124.505 1.122 . . . . 0.0 108.691 173.147 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 66.5 t-105 -93.79 127.94 39.78 Favored 'General case' 0 CA--C 1.561 1.378 0 CA-C-O 122.505 1.145 . . . . 0.0 112.165 -170.423 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 34.6 mtmm -102.2 -56.74 2.2 Favored 'General case' 0 CA--C 1.564 1.508 0 CA-C-N 114.029 -1.441 . . . . 74.430000000000007 111.694 166.531 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.501 0 O-C-N 117.117 -3.489 . . . . 24.350000000000001 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 60.2 m-20 . . . . . 0 CA--C 1.574 1.896 0 CA-C-O 117.938 -1.029 . . . . 73.01 112.444 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -63.6 138.34 64.12 Favored 'Trans proline' 0 CA--C 1.576 2.603 0 C-N-CA 122.934 2.423 . . . . 64.04 115.429 -178.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo . . . . . 0 CA--C 1.575 2.565 0 N-CA-C 119.841 2.977 . . . . 73.35 119.841 12.385 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 . . . . . 0 CA--C 1.56 1.339 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 63.6 t-105 . . . . . 0 CA--C 1.563 1.473 0 CA-C-O 122.386 1.089 . . . . 0.0 111.106 -176.387 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 . . . . . 0 CA--C 1.575 1.928 0 CA-C-O 118.258 -0.877 . . . . 73.01 112.941 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -67.39 142.29 59.31 Favored 'Trans proline' 0 CA--C 1.574 2.48 0 C-N-CA 123.027 2.485 . . . . 64.04 116.027 -176.333 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo . . . . . 0 CA--C 1.576 2.579 0 N-CA-C 119.745 2.94 . . . . 73.35 119.745 9.419 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.4 mmp_? . . . . . 0 N--CA 1.485 1.322 0 CA-C-O 122.231 1.015 . . . . 0.0 110.094 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 67.1 t-105 . . . . . 0 CA--C 1.564 1.49 0 CA-C-O 122.595 1.188 . . . . 0.0 110.994 176.851 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 73.5 m-20 . . . . . 0 CA--C 1.573 1.844 0 CA-C-O 117.871 -1.061 . . . . 73.01 112.462 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -53.85 138.74 69.27 Favored 'Trans proline' 0 CA--C 1.576 2.581 0 C-N-CA 123.175 2.583 . . . . 64.04 117.762 173.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo . . . . . 0 CA--C 1.574 2.478 0 N-CA-C 119.263 2.755 . . . . 73.35 119.263 6.113 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 36.9 ptt180 . . . . . 0 CA--C 1.563 1.466 0 CA-C-O 121.199 0.523 . . . . 0.0 112.186 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 71.4 t-105 . . . . . 0 CA--C 1.562 1.434 0 CA-C-O 122.396 1.093 . . . . 0.0 110.107 171.481 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 37.9 m-20 . . . . . 0 CA--C 1.573 1.864 0 CA-C-O 117.713 -1.137 . . . . 73.01 112.729 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -67.44 137.92 44.54 Favored 'Trans proline' 0 CA--C 1.574 2.49 0 C-N-CA 123.063 2.509 . . . . 64.04 116.258 -174.76 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo . . . . . 0 CA--C 1.574 2.476 0 N-CA-C 119.636 2.898 . . . . 73.35 119.636 11.688 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 29.2 mtt85 . . . . . 0 CA--C 1.561 1.375 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 69.6 t-105 . . . . . 0 CA--C 1.561 1.381 0 CA-C-O 122.596 1.189 . . . . 0.0 110.69 179.125 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 36.3 m-20 . . . . . 0 CA--C 1.574 1.883 0 CA-C-O 117.728 -1.13 . . . . 73.01 111.25 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_exo -49.26 133.92 30.53 Favored 'Trans proline' 0 CA--C 1.576 2.62 0 C-N-CA 123.425 2.75 . . . . 64.04 118.378 176.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo . . . . . 0 CA--C 1.575 2.547 0 CA-C-N 123.057 2.128 . . . . 73.35 116.055 6.623 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 82.6 mtp180 . . . . . 0 CA--C 1.561 1.399 0 CA-C-O 121.481 0.658 . . . . 0.0 109.724 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 71.0 t-105 . . . . . 0 CA--C 1.561 1.381 0 CA-C-O 122.625 1.202 . . . . 0.0 111.465 -175.257 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 . . . . . 0 CA--C 1.576 1.949 0 CA-C-O 117.756 -1.116 . . . . 73.01 112.4 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_exo -51.59 140.82 44.54 Favored 'Trans proline' 0 CA--C 1.575 2.534 0 N-CA-C 119.17 2.719 . . . . 64.04 119.17 179.633 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_exo . . . . . 0 CA--C 1.572 2.422 0 N-CA-C 120.643 3.286 . . . . 73.35 120.643 0.072 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.8 mpt_? . . . . . 0 CA--C 1.561 1.399 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 66.9 t-105 . . . . . 0 CA--C 1.566 1.57 0 O-C-N 121.125 -0.984 . . . . 0.0 111.602 -179.315 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 54.9 m-20 . . . . . 0 CA--C 1.573 1.831 0 CA-C-O 117.721 -1.133 . . . . 73.01 112.239 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -67.16 140.75 54.82 Favored 'Trans proline' 0 CA--C 1.575 2.529 0 C-N-CA 122.883 2.389 . . . . 64.04 115.57 -177.048 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo . . . . . 0 CA--C 1.571 2.359 0 N-CA-C 122.067 3.833 . . . . 73.35 122.067 9.113 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 . . . . . 0 CA--C 1.561 1.382 0 CA-C-O 121.639 0.733 . . . . 0.0 109.921 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 65.4 t-105 . . . . . 0 CA--C 1.56 1.352 0 CA-C-O 122.388 1.09 . . . . 0.0 110.337 177.399 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 . . . . . 0 CA--C 1.574 1.896 0 CA-C-O 118.55 -0.738 . . . . 73.01 112.145 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_endo -70.56 148.34 59.7 Favored 'Trans proline' 0 CA--C 1.58 2.776 0 C-N-CA 122.565 2.176 . . . . 64.04 115.231 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 24.9 Cg_endo . . . . . 0 CA--C 1.574 2.512 0 CA-C-N 122.959 2.093 . . . . 73.35 115.191 6.02 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 87.7 mmt-85 . . . . . 0 CA--C 1.562 1.42 0 CA-C-O 121.22 0.533 . . . . 0.0 109.698 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 71.5 t-105 . . . . . 0 CA--C 1.564 1.488 0 CA-C-O 122.4 1.095 . . . . 0.0 111.024 -178.328 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 56.9 m-20 . . . . . 0 CA--C 1.574 1.892 0 CA-C-O 118.281 -0.866 . . . . 73.01 112.889 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -54.3 141.66 70.54 Favored 'Trans proline' 0 CA--C 1.576 2.583 0 C-N-CA 123.333 2.688 . . . . 64.04 117.786 172.204 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo . . . . . 0 CA--C 1.575 2.527 0 N-CA-C 119.097 2.691 . . . . 73.35 119.097 4.468 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 28.7 mmm180 . . . . . 0 CA--C 1.561 1.402 0 CA-C-O 121.824 0.821 . . . . 0.0 110.343 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 64.6 t-105 . . . . . 0 CA--C 1.564 1.502 0 CA-C-O 122.617 1.199 . . . . 0.0 110.77 175.356 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 . . . . . 0 CA--C 1.573 1.834 0 CA-C-O 117.713 -1.136 . . . . 73.01 111.824 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -63.83 135.94 50.8 Favored 'Trans proline' 0 CA--C 1.576 2.592 0 C-N-CA 122.909 2.406 . . . . 64.04 115.754 -175.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo . . . . . 0 CA--C 1.577 2.657 0 N-CA-C 117.835 2.206 . . . . 73.35 117.835 10.957 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 78.2 mmt-85 . . . . . 0 CA--C 1.562 1.428 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 66.5 t-105 . . . . . 0 CA--C 1.561 1.378 0 CA-C-O 122.505 1.145 . . . . 0.0 112.165 -170.423 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.224 -0.25 . . . . . . . . 25.23 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 60.2 m-20 -99.56 134.89 20.81 Favored Pre-proline 0 CA--C 1.574 1.896 0 CA-C-O 117.938 -1.029 . . . . 73.01 112.444 -170.086 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -63.6 138.34 64.12 Favored 'Trans proline' 0 CA--C 1.576 2.603 0 C-N-CA 122.934 2.423 . . . . 64.04 115.429 -178.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -85.0 18.72 26.24 Favored 'Cis proline' 0 CA--C 1.575 2.565 0 N-CA-C 119.841 2.977 . . . . 73.35 119.841 12.385 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' 4J2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -108.98 133.35 53.09 Favored 'General case' 0 CA--C 1.56 1.339 0 C-N-CA 124.924 1.29 . . . . 0.0 108.128 176.364 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 63.6 t-105 -83.67 126.1 32.53 Favored 'General case' 0 CA--C 1.563 1.473 0 CA-C-O 122.386 1.089 . . . . 0.0 111.106 -176.387 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.9 ttmp? -101.91 -52.15 3.25 Favored 'General case' 0 CA--C 1.564 1.488 0 CA-C-N 114.333 -1.303 . . . . 74.43 113.876 -170.47 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.574 0 O-C-N 116.946 -3.596 . . . . 24.35 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.227 -0.08 . . . . . . . . 25.23 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -98.5 131.06 26.71 Favored Pre-proline 0 CA--C 1.575 1.928 0 CA-C-O 118.258 -0.877 . . . . 73.01 112.941 -171.216 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -67.39 142.29 59.31 Favored 'Trans proline' 0 CA--C 1.574 2.48 0 C-N-CA 123.027 2.485 . . . . 64.04 116.027 -176.333 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -84.23 19.18 22.42 Favored 'Cis proline' 0 CA--C 1.576 2.579 0 N-CA-C 119.745 2.94 . . . . 73.35 119.745 9.419 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' 4J2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.4 mmp_? -95.39 144.23 26.1 Favored 'General case' 0 N--CA 1.485 1.322 0 CA-C-O 122.231 1.015 . . . . 0.0 110.094 158.313 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 67.1 t-105 -79.69 134.79 36.42 Favored 'General case' 0 CA--C 1.564 1.49 0 CA-C-O 122.595 1.188 . . . . 0.0 110.994 176.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -88.76 81.85 6.91 Favored 'General case' 0 CA--C 1.561 1.371 0 CA-C-O 123.604 1.668 . . . . 74.43 110.336 -179.46 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.316 -0.888 0 O-C-N 117.326 -3.359 . . . . 24.35 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 -0.015 . . . . . . . . 25.23 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 73.5 m-20 -115.68 132.15 23.3 Favored Pre-proline 0 CA--C 1.573 1.844 0 CA-C-O 117.871 -1.061 . . . . 73.01 112.462 -169.215 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -53.85 138.74 69.27 Favored 'Trans proline' 0 CA--C 1.576 2.581 0 C-N-CA 123.175 2.583 . . . . 64.04 117.762 173.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -82.68 18.61 18.84 Favored 'Cis proline' 0 CA--C 1.574 2.478 0 N-CA-C 119.263 2.755 . . . . 73.35 119.263 6.113 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' 4J2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 36.9 ptt180 -90.11 148.31 23.08 Favored 'General case' 0 CA--C 1.563 1.466 0 C-N-CA 123.343 0.657 . . . . 0.0 112.186 161.479 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 71.4 t-105 -106.32 124.97 50.41 Favored 'General case' 0 CA--C 1.562 1.434 0 CA-C-O 122.396 1.093 . . . . 0.0 110.107 171.481 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 19.4 pttm -124.45 72.26 1.19 Allowed 'General case' 0 CA--C 1.565 1.532 0 CA-C-O 123.752 1.739 . . . . 74.43 111.1 175.469 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.32 -0.705 0 O-C-N 116.656 -3.778 . . . . 24.35 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 -0.017 . . . . . . . . 25.23 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 37.9 m-20 -113.59 128.07 26.12 Favored Pre-proline 0 CA--C 1.573 1.864 0 CA-C-O 117.713 -1.137 . . . . 73.01 112.729 -168.054 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -67.44 137.92 44.54 Favored 'Trans proline' 0 CA--C 1.574 2.49 0 C-N-CA 123.063 2.509 . . . . 64.04 116.258 -174.76 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -86.51 20.78 24.92 Favored 'Cis proline' 0 CA--C 1.574 2.476 0 N-CA-C 119.636 2.898 . . . . 73.35 119.636 11.688 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' 4J2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 29.2 mtt85 -94.26 129.69 40.81 Favored 'General case' 0 CA--C 1.561 1.375 0 C-N-CA 124.013 0.925 . . . . 0.0 108.983 168.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 69.6 t-105 -98.38 125.66 43.61 Favored 'General case' 0 CA--C 1.561 1.381 0 CA-C-O 122.596 1.189 . . . . 0.0 110.69 179.125 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 18.3 pttm -130.96 65.15 1.56 Allowed 'General case' 0 CA--C 1.565 1.548 0 CA-C-O 123.539 1.638 . . . . 74.43 111.735 178.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.321 -0.663 0 O-C-N 116.666 -3.771 . . . . 24.35 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 -0.004 . . . . . . . . 25.23 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 36.3 m-20 -108.45 128.17 26.11 Favored Pre-proline 0 CA--C 1.574 1.883 0 CA-C-O 117.728 -1.13 . . . . 73.01 111.25 175.23 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_exo -49.26 133.92 30.53 Favored 'Trans proline' 0 CA--C 1.576 2.62 0 C-N-CA 123.425 2.75 . . . . 64.04 118.378 176.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo -92.23 57.98 0.56 Allowed 'Cis proline' 0 CA--C 1.575 2.547 0 CA-C-N 123.057 2.128 . . . . 73.35 116.055 6.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' 4J2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 82.6 mtp180 -90.89 134.51 34.41 Favored 'General case' 0 CA--C 1.561 1.399 0 C-N-CA 123.982 0.913 . . . . 0.0 109.724 163.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 71.0 t-105 -101.45 125.64 48.12 Favored 'General case' 0 CA--C 1.561 1.381 0 CA-C-O 122.625 1.202 . . . . 0.0 111.465 -175.257 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.0 pttm -125.07 76.37 1.53 Allowed 'General case' 0 CA--C 1.565 1.52 0 CA-C-O 123.672 1.701 . . . . 74.43 110.81 173.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.319 -0.739 0 O-C-N 116.85 -3.656 . . . . 24.35 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.13 . . . . . . . . 25.23 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -108.46 131.14 21.96 Favored Pre-proline 0 CA--C 1.576 1.949 0 CA-C-O 117.756 -1.116 . . . . 73.01 112.4 -174.489 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_exo -51.59 140.82 44.54 Favored 'Trans proline' 0 CA--C 1.575 2.534 0 N-CA-C 119.17 2.719 . . . . 64.04 119.17 179.633 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_exo -73.39 8.11 7.18 Favored 'Cis proline' 0 CA--C 1.572 2.422 0 N-CA-C 120.643 3.286 . . . . 73.35 120.643 0.072 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' 4J2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.8 mpt_? -92.44 131.7 37.38 Favored 'General case' 0 CA--C 1.561 1.399 0 C-N-CA 123.849 0.86 . . . . 0.0 109.371 165.594 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 66.9 t-105 -83.72 136.27 34.24 Favored 'General case' 0 CA--C 1.566 1.57 0 O-C-N 121.125 -0.984 . . . . 0.0 111.602 -179.315 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 44.1 mmtm -74.02 -51.34 16.18 Favored 'General case' 0 N--CA 1.491 1.602 0 N-CA-C 115.405 1.631 . . . . 74.43 115.405 -179.015 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.321 -0.67 0 O-C-N 117.074 -3.517 . . . . 24.35 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.068 . . . . . . . . 25.23 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 54.9 m-20 -120.38 125.1 27.37 Favored Pre-proline 0 CA--C 1.573 1.831 0 CA-C-O 117.721 -1.133 . . . . 73.01 112.239 -164.294 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -67.16 140.75 54.82 Favored 'Trans proline' 0 CA--C 1.575 2.529 0 C-N-CA 122.883 2.389 . . . . 64.04 115.57 -177.048 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -74.77 5.09 12.22 Favored 'Cis proline' 0 CA--C 1.571 2.359 0 N-CA-C 122.067 3.833 . . . . 73.35 122.067 9.113 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' 4J2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -95.82 139.23 32.34 Favored 'General case' 0 CA--C 1.561 1.382 0 C-N-CA 123.694 0.798 . . . . 0.0 109.921 163.328 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 65.4 t-105 -98.05 126.72 43.62 Favored 'General case' 0 CA--C 1.56 1.352 0 CA-C-O 122.388 1.09 . . . . 0.0 110.337 177.399 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 34.4 mtmm -100.15 -50.35 4.0 Favored 'General case' 0 CA--C 1.564 1.513 0 CA-C-N 114.402 -1.272 . . . . 74.43 112.696 169.582 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.539 0 O-C-N 116.884 -3.635 . . . . 24.35 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.06 . . . . . . . . 25.23 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -121.19 138.78 28.43 Favored Pre-proline 0 CA--C 1.574 1.896 0 C-N-CA 124.452 1.101 . . . . 73.01 112.145 -168.323 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_endo -70.56 148.34 59.7 Favored 'Trans proline' 0 CA--C 1.58 2.776 0 C-N-CA 122.565 2.176 . . . . 64.04 115.231 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 24.9 Cg_endo -99.43 62.68 0.52 Allowed 'Cis proline' 0 CA--C 1.574 2.512 0 CA-C-N 122.959 2.093 . . . . 73.35 115.191 6.02 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' 4J2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 87.7 mmt-85 -136.69 145.64 44.97 Favored 'General case' 0 CA--C 1.562 1.42 0 C-N-CA 124.013 0.925 . . . . 0.0 109.698 -172.709 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 71.5 t-105 -121.58 126.74 49.84 Favored 'General case' 0 CA--C 1.564 1.488 0 CA-C-O 122.4 1.095 . . . . 0.0 111.024 -178.328 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 29.5 mtmm -94.33 88.76 5.66 Favored 'General case' 0 CA--C 1.562 1.416 0 CA-C-O 123.453 1.597 . . . . 74.43 110.053 172.211 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.318 -0.776 0 O-C-N 117.245 -3.41 . . . . 24.35 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 -0.01 . . . . . . . . 25.23 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 56.9 m-20 -117.25 132.56 23.45 Favored Pre-proline 0 CA--C 1.574 1.892 0 CA-C-O 118.281 -0.866 . . . . 73.01 112.889 -169.802 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -54.3 141.66 70.54 Favored 'Trans proline' 0 CA--C 1.576 2.583 0 C-N-CA 123.333 2.688 . . . . 64.04 117.786 172.204 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -81.77 17.65 18.24 Favored 'Cis proline' 0 CA--C 1.575 2.527 0 N-CA-C 119.097 2.691 . . . . 73.35 119.097 4.468 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' 4J2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 28.7 mmm180 -105.0 148.69 26.46 Favored 'General case' 0 CA--C 1.561 1.402 0 C-N-CA 123.891 0.876 . . . . 0.0 110.343 162.767 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 64.6 t-105 -85.17 132.56 34.27 Favored 'General case' 0 CA--C 1.564 1.502 0 CA-C-O 122.617 1.199 . . . . 0.0 110.77 175.356 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.8 ttmp? -106.85 -52.9 2.7 Favored 'General case' 0 CA--C 1.564 1.514 0 CA-C-N 114.256 -1.338 . . . . 74.43 112.705 -178.195 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.538 0 O-C-N 117.065 -3.522 . . . . 24.35 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.097 . . . . . . . . 25.23 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' NLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 -105.16 133.39 20.18 Favored Pre-proline 0 CA--C 1.573 1.834 0 CA-C-O 117.713 -1.136 . . . . 73.01 111.824 -177.32 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -63.83 135.94 50.8 Favored 'Trans proline' 0 CA--C 1.576 2.592 0 C-N-CA 122.909 2.406 . . . . 64.04 115.754 -175.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -91.78 45.81 1.84 Allowed 'Cis proline' 0 CA--C 1.577 2.657 0 N-CA-C 117.835 2.206 . . . . 73.35 117.835 10.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' 4J2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 78.2 mmt-85 -117.08 135.04 54.03 Favored 'General case' 0 CA--C 1.562 1.428 0 C-N-CA 124.505 1.122 . . . . 0.0 108.691 173.147 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 66.5 t-105 -93.79 127.94 39.78 Favored 'General case' 0 CA--C 1.561 1.378 0 CA-C-O 122.505 1.145 . . . . 0.0 112.165 -170.423 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 34.6 mtmm -102.2 -56.74 2.2 Favored 'General case' 0 CA--C 1.564 1.508 0 CA-C-N 114.029 -1.441 . . . . 74.43 111.694 166.531 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.501 0 O-C-N 117.117 -3.489 . . . . 24.35 . . . . . . . . . . 0 0 . 1 stop_ save_