data_2i1g_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 2i1g _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.852 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.541 0.624 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . 0.852 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 99.6 Cg_exo -48.78 163.13 0.31 Allowed 'Trans proline' 0 C--N 1.363 1.342 0 C-N-CA 122.942 2.428 . . . . 0.0 113.557 -179.579 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.447 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 35.9 p-90 -70.09 -33.53 72.0 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 177.541 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.617 ' CH2' ' HG2' ' A' ' 5' ' ' PRO . 11.6 p-90 -83.76 -16.88 43.11 Favored 'General case' 0 CA--C 1.498 -1.054 0 CA-C-N 114.845 -1.07 . . . . 0.0 111.566 178.923 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.669 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 29.0 t-105 -61.05 -44.84 95.7 Favored Pre-proline 0 N--CA 1.426 -1.663 0 C-N-CA 119.271 -0.972 . . . . 0.0 112.548 -176.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.78 ' HA ' ' HB3' ' A' ' 13' ' ' ARG . 81.8 Cg_exo -43.36 -47.48 9.01 Favored 'Trans proline' 0 N--CA 1.46 -0.493 0 C-N-CA 122.129 1.886 . . . . 0.0 112.87 -178.404 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -58.04 -35.23 71.0 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.463 0.649 . . . . 0.0 109.329 179.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.669 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 9.6 mt -62.25 -41.31 98.33 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 114.889 -1.051 . . . . 0.0 111.766 -179.613 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.401 HH11 ' HG2' ' A' ' 12' ' ' ARG . 53.4 ttt-85 -146.2 -47.79 0.2 Allowed 'General case' 0 CA--C 1.529 0.145 0 N-CA-C 112.257 0.466 . . . . 0.0 112.257 -178.523 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.78 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 3.3 tmt_? . . . . . 0 C--O 1.249 1.028 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.891 -179.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.861 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.542 0.672 0 N-CA-C 111.903 0.335 . . . . 0.0 111.903 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . 0.861 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 92.0 Cg_exo -48.53 156.8 1.65 Allowed 'Trans proline' 0 C--N 1.364 1.376 0 C-N-CA 122.736 2.291 . . . . 0.0 113.511 -179.616 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 35.3 p-90 -64.35 -32.0 73.44 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 177.669 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.593 ' CH2' ' HG2' ' A' ' 5' ' ' PRO . 11.4 p-90 -84.99 -17.62 37.03 Favored 'General case' 0 CA--C 1.499 -0.989 0 CA-C-N 115.13 -0.941 . . . . 0.0 111.591 179.074 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.664 ' N ' ' HD2' ' A' ' 9' ' ' PRO . 26.4 t-105 -60.18 -44.15 95.61 Favored Pre-proline 0 N--CA 1.428 -1.559 0 C-N-CA 119.291 -0.964 . . . . 0.0 113.293 -176.576 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.806 ' HA ' ' HB3' ' A' ' 13' ' ' ARG . 2.1 Cg_endo -46.68 -44.55 21.5 Favored 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.05 1.834 . . . . 0.0 112.758 -178.231 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -59.78 -33.94 72.35 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 179.135 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.644 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 11.9 mt -62.28 -44.19 97.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 114.952 -1.022 . . . . 0.0 112.138 -179.498 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 79.5 ttt180 -139.57 -46.21 0.45 Allowed 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 112.222 0.452 . . . . 0.0 112.222 -178.438 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.806 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 11.7 tpt180 . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.098 -0.953 . . . . 0.0 111.389 -179.722 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.843 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.542 0.641 0 N-CA-C 111.528 0.195 . . . . 0.0 111.528 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . 0.843 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 83.1 Cg_exo -49.34 161.66 0.65 Allowed 'Trans proline' 0 C--N 1.363 1.331 0 C-N-CA 122.793 2.329 . . . . 0.0 113.371 -179.804 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.487 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 40.1 p-90 -68.64 -33.69 74.45 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 108.069 -1.085 . . . . 0.0 108.069 177.425 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.594 ' CH2' ' HG2' ' A' ' 5' ' ' PRO . 11.4 p-90 -82.55 -15.48 52.16 Favored 'General case' 0 CA--C 1.495 -1.144 0 CA-C-N 114.883 -1.053 . . . . 0.0 111.311 178.749 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.649 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 29.5 t-105 -61.56 -45.46 93.78 Favored Pre-proline 0 N--CA 1.425 -1.707 0 C-N-CA 119.355 -0.938 . . . . 0.0 112.741 -176.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.549 ' HD3' ' O ' ' A' ' 5' ' ' PRO . 82.3 Cg_exo -43.8 -44.14 11.68 Favored 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.234 1.956 . . . . 0.0 112.905 -178.511 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -61.64 -34.83 76.38 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.384 0.611 . . . . 0.0 109.595 179.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.649 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 12.5 mt -59.47 -46.62 88.26 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 114.958 -1.019 . . . . 0.0 112.196 -179.297 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 43.3 mtp85 -129.69 -47.49 1.15 Allowed 'General case' 0 C--N 1.332 -0.155 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -178.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.414 ' HB2' ' HA ' ' A' ' 9' ' ' PRO . 40.0 mmm-85 . . . . . 0 C--O 1.25 1.107 0 CA-C-O 118.116 -0.945 . . . . 0.0 110.741 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.876 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.54 0.587 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . 0.876 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 97.0 Cg_exo -48.7 166.94 0.13 Allowed 'Trans proline' 0 C--N 1.365 1.431 0 C-N-CA 123.08 2.52 . . . . 0.0 113.635 -179.429 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.444 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 33.9 p-90 -72.75 -34.27 66.91 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 177.43 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.647 ' CH2' ' HG2' ' A' ' 5' ' ' PRO . 10.9 p-90 -83.19 -17.33 43.23 Favored 'General case' 0 CA--C 1.498 -1.041 0 CA-C-N 114.813 -1.085 . . . . 0.0 111.604 178.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.661 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 26.8 t-105 -61.57 -45.25 93.7 Favored Pre-proline 0 N--CA 1.425 -1.71 0 C-N-CA 119.279 -0.969 . . . . 0.0 112.612 -176.938 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.565 ' HA ' ' HB3' ' A' ' 13' ' ' ARG . 99.8 Cg_exo -42.73 -43.34 8.83 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.444 2.096 . . . . 0.0 113.098 -178.333 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 4.7 m-85 -63.48 -35.42 80.38 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.478 0.656 . . . . 0.0 109.603 179.404 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.661 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 10.7 mt -60.33 -50.91 71.76 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.839 -1.073 . . . . 0.0 112.387 -179.198 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 44.2 ttt85 -125.27 -46.71 1.77 Allowed 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -178.239 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.565 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 12.0 tpt180 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.005 -0.998 . . . . 0.0 111.276 -179.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.872 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.541 0.619 0 CA-C-O 119.617 -0.23 . . . . 0.0 111.129 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . 0.872 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 93.4 Cg_exo -47.96 157.77 1.01 Allowed 'Trans proline' 0 C--N 1.366 1.488 0 C-N-CA 122.438 2.092 . . . . 0.0 113.057 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.488 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 42.0 p-90 -64.93 -33.14 75.33 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 177.62 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.543 ' CH2' ' HG2' ' A' ' 5' ' ' PRO . 11.9 p-90 -83.19 -14.56 53.13 Favored 'General case' 0 CA--C 1.497 -1.058 0 CA-C-N 115.009 -0.996 . . . . 0.0 111.439 178.734 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.633 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 32.6 t-105 -61.35 -45.81 94.88 Favored Pre-proline 0 N--CA 1.427 -1.597 0 C-N-CA 119.195 -1.002 . . . . 0.0 112.352 -177.273 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.55 ' HD3' ' O ' ' A' ' 5' ' ' PRO . 85.1 Cg_exo -43.97 -44.13 12.17 Favored 'Trans proline' 0 C--N 1.348 0.508 0 C-N-CA 122.111 1.874 . . . . 0.0 112.314 -178.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -59.75 -36.95 77.68 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 179.137 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.633 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 9.3 mt -63.15 -68.15 0.36 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 114.983 -1.008 . . . . 0.0 111.637 -179.704 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.548 ' HG3' ' HE1' ' A' ' 8' ' ' TRP . 13.4 mmp_? -92.4 -55.59 3.35 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -178.799 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.409 HH11 ' HG3' ' A' ' 13' ' ' ARG . 32.4 tpt85 . . . . . 0 C--O 1.249 1.052 0 CA-C-O 117.966 -1.016 . . . . 0.0 111.32 -179.258 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.82 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.54 0.586 0 N-CA-C 111.638 0.236 . . . . 0.0 111.638 . . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . 0.82 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 79.9 Cg_exo -49.59 160.46 1.07 Allowed 'Trans proline' 0 C--N 1.364 1.351 0 C-N-CA 122.773 2.315 . . . . 0.0 113.333 -179.751 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.502 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 32.4 p-90 -67.82 -33.11 74.15 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 177.401 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.601 ' CH2' ' HG2' ' A' ' 5' ' ' PRO . 10.9 p-90 -83.01 -15.91 49.24 Favored 'General case' 0 CA--C 1.496 -1.117 0 CA-C-N 114.985 -1.007 . . . . 0.0 111.233 178.748 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.636 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 29.4 t-105 -61.2 -44.8 94.79 Favored Pre-proline 0 N--CA 1.426 -1.666 0 C-N-CA 119.408 -0.917 . . . . 0.0 112.649 -177.088 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.569 ' HD3' ' O ' ' A' ' 5' ' ' PRO . 88.5 Cg_exo -42.91 -45.68 8.95 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.316 2.011 . . . . 0.0 112.758 -178.653 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 7.4 m-85 -59.23 -36.31 75.21 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.399 0.618 . . . . 0.0 109.392 179.285 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.636 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 7.5 mt -64.01 -70.17 0.24 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.959 -1.018 . . . . 0.0 111.665 -179.668 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 54.4 ttt-85 -86.92 -56.32 3.44 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 115.94 -0.573 . . . . 0.0 112.067 -178.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.409 ' HG3' HH11 ' A' ' 13' ' ' ARG . 43.7 mmm-85 . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.089 -0.958 . . . . 0.0 111.282 -179.465 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.874 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.542 0.64 0 CA-C-O 119.861 -0.114 . . . . 0.0 111.131 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . 0.874 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 88.3 Cg_exo -48.99 154.41 3.29 Favored 'Trans proline' 0 C--N 1.363 1.302 0 C-N-CA 122.579 2.186 . . . . 0.0 113.209 -179.786 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 42.6 p-90 -61.83 -32.58 72.91 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 177.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.562 ' CH2' ' HG2' ' A' ' 5' ' ' PRO . 11.9 p-90 -84.57 -17.32 39.18 Favored 'General case' 0 CA--C 1.499 -0.991 0 CA-C-N 115.05 -0.977 . . . . 0.0 111.814 179.074 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.66 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 25.8 t-105 -60.3 -44.96 97.45 Favored Pre-proline 0 N--CA 1.428 -1.552 0 C-N-CA 119.254 -0.978 . . . . 0.0 113.548 -176.461 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.659 ' HD2' ' N ' ' A' ' 8' ' ' TRP . 1.2 Cg_endo -45.67 -44.28 17.78 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.175 1.916 . . . . 0.0 112.802 -178.099 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -60.94 -33.74 73.64 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.371 0.605 . . . . 0.0 109.463 179.279 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.66 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 12.9 mt -60.85 -49.17 78.57 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 114.955 -1.02 . . . . 0.0 112.262 -179.198 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 79.3 ttt180 -130.11 -46.26 1.12 Allowed 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -178.336 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.514 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 28.5 tpt180 . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.335 -0.841 . . . . 0.0 111.526 -179.171 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.831 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.539 0.531 0 N-CA-C 111.585 0.217 . . . . 0.0 111.585 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . 0.831 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 80.9 Cg_exo -49.98 164.36 0.43 Allowed 'Trans proline' 0 C--N 1.362 1.239 0 C-N-CA 123.065 2.51 . . . . 0.0 113.708 -179.421 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.485 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 34.5 p-90 -71.03 -33.51 70.38 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 177.348 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.625 ' CH2' ' HG2' ' A' ' 5' ' ' PRO . 10.7 p-90 -83.18 -15.93 48.61 Favored 'General case' 0 CA--C 1.497 -1.081 0 CA-C-N 114.836 -1.074 . . . . 0.0 111.2 178.622 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.666 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 29.1 t-105 -61.61 -44.81 92.86 Favored Pre-proline 0 N--CA 1.426 -1.657 0 C-N-CA 119.281 -0.968 . . . . 0.0 112.42 -177.159 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.545 ' HD3' ' O ' ' A' ' 5' ' ' PRO . 80.7 Cg_exo -43.17 -44.66 9.83 Favored 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 122.308 2.005 . . . . 0.0 112.459 -178.606 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -59.93 -37.74 80.35 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 179.134 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.666 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 6.9 mt -63.34 -68.58 0.33 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 114.951 -1.022 . . . . 0.0 111.513 -179.79 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 12.1 tpt180 -86.12 -59.0 2.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.79 -0.641 . . . . 0.0 112.028 -178.735 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.468 ' HE ' ' HH ' ' A' ' 4' ' ' TYR . 37.0 mmt180 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.083 -0.96 . . . . 0.0 111.424 -179.209 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.876 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.54 0.576 0 N-CA-C 111.339 0.125 . . . . 0.0 111.339 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . 0.876 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 97.9 Cg_exo -48.23 156.1 1.73 Allowed 'Trans proline' 0 C--N 1.364 1.349 0 C-N-CA 122.669 2.246 . . . . 0.0 113.328 -179.649 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 38.6 p-90 -63.55 -31.59 72.8 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 177.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.593 ' CH2' ' HG2' ' A' ' 5' ' ' PRO . 11.5 p-90 -85.61 -18.0 34.57 Favored 'General case' 0 CA--C 1.499 -0.989 0 CA-C-N 115.088 -0.96 . . . . 0.0 111.75 179.086 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.655 ' N ' ' HD2' ' A' ' 9' ' ' PRO . 25.6 t-105 -59.8 -44.27 96.79 Favored Pre-proline 0 N--CA 1.428 -1.532 0 C-N-CA 119.349 -0.94 . . . . 0.0 113.156 -176.598 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.655 ' HD2' ' N ' ' A' ' 8' ' ' TRP . 1.8 Cg_endo -46.96 -43.91 23.65 Favored 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 121.934 1.756 . . . . 0.0 112.34 -178.41 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -58.7 -35.1 72.1 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 178.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.626 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 9.1 mt -65.45 -70.07 0.26 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 114.793 -1.094 . . . . 0.0 111.551 -179.694 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 78.3 ttt180 -86.75 -56.2 3.51 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.953 -0.567 . . . . 0.0 112.006 -179.074 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.481 ' HE ' ' HH ' ' A' ' 4' ' ' TYR . 37.5 mmt180 . . . . . 0 C--O 1.25 1.093 0 CA-C-O 118.076 -0.964 . . . . 0.0 111.499 -179.182 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.879 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.541 0.626 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . 0.879 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 88.7 Cg_exo -50.74 159.66 2.19 Favored 'Trans proline' 0 C--N 1.361 1.211 0 C-N-CA 123.095 2.53 . . . . 0.0 113.721 -179.466 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 45.8 p-90 -66.93 -31.4 71.96 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 177.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.606 ' CH2' ' HG2' ' A' ' 5' ' ' PRO . 10.6 p-90 -85.67 -17.37 36.24 Favored 'General case' 0 CA--C 1.496 -1.1 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.468 179.059 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.684 ' N ' ' HD2' ' A' ' 9' ' ' PRO . 25.2 t-105 -60.2 -43.9 94.89 Favored Pre-proline 0 N--CA 1.424 -1.735 0 C-N-CA 119.11 -1.036 . . . . 0.0 113.048 -176.871 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.684 ' HD2' ' N ' ' A' ' 8' ' ' TRP . 1.8 Cg_endo -46.09 -43.13 20.83 Favored 'Trans proline' 0 N--CA 1.459 -0.51 0 C-N-CA 122.169 1.913 . . . . 0.0 112.625 -178.355 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 -61.66 -33.72 74.46 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.424 0.63 . . . . 0.0 109.31 179.162 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.672 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 12.8 mt -61.56 -48.19 82.11 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 114.929 -1.032 . . . . 0.0 112.188 -179.383 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 56.6 ttp85 -127.88 -48.17 1.37 Allowed 'General case' 0 C--O 1.231 0.126 0 N-CA-C 111.976 0.362 . . . . 0.0 111.976 -178.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.55 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 29.7 tpt180 . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.081 -0.962 . . . . 0.0 111.377 -179.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.826 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.541 0.622 0 CA-C-O 119.65 -0.214 . . . . 0.0 111.083 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . 0.826 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 96.4 Cg_exo -48.03 158.15 0.95 Allowed 'Trans proline' 0 C--N 1.367 1.51 0 C-N-CA 122.527 2.151 . . . . 0.0 113.092 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.469 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 39.3 p-90 -65.07 -33.38 75.9 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 177.641 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.585 ' CH2' ' HG2' ' A' ' 5' ' ' PRO . 12.1 p-90 -83.44 -15.82 48.15 Favored 'General case' 0 CA--C 1.497 -1.067 0 CA-C-N 115.117 -0.947 . . . . 0.0 111.541 178.93 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.632 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 32.9 t-105 -60.63 -44.74 96.28 Favored Pre-proline 0 N--CA 1.426 -1.656 0 C-N-CA 119.284 -0.967 . . . . 0.0 112.446 -177.105 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.843 ' HA ' ' HB3' ' A' ' 13' ' ' ARG . 84.3 Cg_exo -43.66 -47.53 9.51 Favored 'Trans proline' 0 N--CA 1.458 -0.562 0 C-N-CA 122.103 1.869 . . . . 0.0 112.621 -178.859 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -56.77 -35.48 68.73 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.443 0.639 . . . . 0.0 109.517 179.262 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.632 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 10.1 mt -62.21 -43.83 97.95 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 114.882 -1.054 . . . . 0.0 111.874 -179.312 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 74.5 mtp180 -141.77 -48.91 0.38 Allowed 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -178.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.843 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.034 -0.984 . . . . 0.0 110.637 -179.694 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.845 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.542 0.655 0 N-CA-C 111.391 0.145 . . . . 0.0 111.391 . . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . 0.845 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 81.0 Cg_exo -48.9 158.14 1.36 Allowed 'Trans proline' 0 C--N 1.365 1.399 0 C-N-CA 122.635 2.223 . . . . 0.0 113.342 -179.794 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.44 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 39.4 p-90 -65.48 -33.68 76.5 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 177.564 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.561 ' CH2' ' HG2' ' A' ' 5' ' ' PRO . 9.9 p-90 -81.93 -17.69 46.23 Favored 'General case' 0 CA--C 1.497 -1.09 0 CA-C-N 115.078 -0.964 . . . . 0.0 111.178 178.557 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.647 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 35.4 t-105 -57.41 -46.49 99.8 Favored Pre-proline 0 N--CA 1.428 -1.546 0 C-N-CA 119.518 -0.873 . . . . 0.0 112.781 -176.948 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.888 ' HA ' ' HB3' ' A' ' 13' ' ' ARG . 89.2 Cg_exo -41.31 -49.63 4.79 Favored 'Trans proline' 0 N--CA 1.458 -0.58 0 C-N-CA 122.266 1.977 . . . . 0.0 112.979 -178.546 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -57.68 -35.75 71.0 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.344 0.592 . . . . 0.0 109.695 179.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.647 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 10.1 mt -59.68 -41.53 90.87 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.829 -179.538 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 72.4 mtt-85 -146.16 -48.12 0.2 Allowed 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 112.381 0.512 . . . . 0.0 112.381 -178.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.888 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 30.7 tpt180 . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.039 -0.981 . . . . 0.0 110.927 -179.623 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.868 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.541 0.598 0 CA-C-O 119.803 -0.141 . . . . 0.0 111.313 . . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . 0.868 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 90.9 Cg_exo -48.78 162.77 0.34 Allowed 'Trans proline' 0 C--N 1.365 1.396 0 C-N-CA 122.731 2.287 . . . . 0.0 113.429 -179.74 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.477 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 33.3 p-90 -69.31 -33.44 73.16 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 177.542 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.619 ' CH2' ' HG2' ' A' ' 5' ' ' PRO . 11.3 p-90 -83.65 -16.0 46.75 Favored 'General case' 0 CA--C 1.498 -1.04 0 CA-C-N 114.945 -1.025 . . . . 0.0 111.359 178.777 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.648 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 29.1 t-105 -61.32 -44.18 92.17 Favored Pre-proline 0 N--CA 1.426 -1.645 0 C-N-CA 119.336 -0.945 . . . . 0.0 112.611 -177.016 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.569 ' HD3' ' O ' ' A' ' 5' ' ' PRO . 86.2 Cg_exo -43.46 -49.4 7.66 Favored 'Trans proline' 0 N--CA 1.46 -0.491 0 C-N-CA 122.174 1.916 . . . . 0.0 112.541 -178.649 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 7.4 m-85 -56.16 -35.35 67.09 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 179.208 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.648 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 6.8 mt -65.93 -70.58 0.23 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.09 -0.959 . . . . 0.0 111.51 -179.795 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.574 ' HA ' ' HE ' ' A' ' 12' ' ' ARG . 5.3 tpm_? -83.08 -57.51 3.25 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.987 -178.809 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 29.0 tpt180 . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.297 -0.859 . . . . 0.0 111.029 -179.386 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.857 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.541 0.612 0 CA-C-O 119.637 -0.22 . . . . 0.0 110.884 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . 0.857 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 94.0 Cg_exo -48.01 155.8 1.66 Allowed 'Trans proline' 0 C--N 1.367 1.527 0 C-N-CA 122.377 2.051 . . . . 0.0 113.067 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.432 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 31.0 p-90 -63.46 -33.8 76.37 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 177.53 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.514 ' CH2' ' HG2' ' A' ' 5' ' ' PRO . 9.7 p-90 -81.39 -16.78 51.15 Favored 'General case' 0 CA--C 1.499 -0.981 0 CA-C-N 114.986 -1.006 . . . . 0.0 111.278 178.618 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.642 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 37.6 t-105 -59.18 -47.25 98.75 Favored Pre-proline 0 N--CA 1.431 -1.378 0 C-N-CA 119.358 -0.937 . . . . 0.0 112.911 -176.822 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.463 ' HD3' ' O ' ' A' ' 5' ' ' PRO . 83.4 Cg_exo -41.33 -44.29 5.71 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.445 2.097 . . . . 0.0 112.704 -178.54 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -61.49 -37.39 83.48 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 179.38 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.642 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 8.0 mt -63.54 -68.55 0.34 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 114.976 -1.011 . . . . 0.0 112.052 -179.415 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.546 ' NE ' ' HA ' ' A' ' 12' ' ' ARG . 5.4 tpm_? -91.13 -55.55 3.49 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.028 -0.533 . . . . 0.0 112.362 -178.163 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 36.5 mmt180 . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.063 -0.97 . . . . 0.0 111.483 -179.213 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.871 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.541 0.631 0 N-CA-C 112.016 0.376 . . . . 0.0 112.016 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . 0.871 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 87.9 Cg_exo -50.56 163.12 0.75 Allowed 'Trans proline' 0 C--N 1.364 1.383 0 C-N-CA 123.13 2.553 . . . . 0.0 113.83 -179.478 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.447 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 33.0 p-90 -69.89 -34.49 73.62 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 177.33 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.613 ' CH2' ' HG2' ' A' ' 5' ' ' PRO . 10.1 p-90 -81.59 -17.51 48.02 Favored 'General case' 0 CA--C 1.496 -1.117 0 CA-C-N 114.976 -1.011 . . . . 0.0 111.11 178.591 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.636 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 42.8 t-105 -58.44 -46.25 99.63 Favored Pre-proline 0 N--CA 1.425 -1.712 0 C-N-CA 119.215 -0.994 . . . . 0.0 112.552 -177.113 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.842 ' HA ' ' HB3' ' A' ' 13' ' ' ARG . 74.3 Cg_exo -40.54 -50.81 3.69 Favored 'Trans proline' 0 N--CA 1.456 -0.684 0 C-N-CA 122.317 2.012 . . . . 0.0 112.766 -178.467 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -55.09 -37.11 66.38 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.38 0.609 . . . . 0.0 109.373 179.445 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.636 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 7.1 mt -62.88 -40.54 97.84 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.067 -0.97 . . . . 0.0 111.225 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 43.3 ttt85 -150.48 -51.59 0.14 Allowed 'General case' 0 CA--C 1.53 0.173 0 N-CA-C 112.002 0.371 . . . . 0.0 112.002 -179.016 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.842 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 12.1 tpt180 . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.06 -0.972 . . . . 0.0 111.179 -179.723 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.832 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.542 0.664 0 CA-C-O 119.685 -0.198 . . . . 0.0 111.004 . . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . 0.832 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 82.4 Cg_exo -49.11 157.23 1.89 Allowed 'Trans proline' 0 C--N 1.366 1.489 0 C-N-CA 122.544 2.162 . . . . 0.0 113.316 -179.801 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.444 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 35.2 p-90 -64.44 -33.97 77.1 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 177.54 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.579 ' CE3' HD12 ' A' ' 11' ' ' LEU . 9.8 p-90 -81.68 -16.21 52.02 Favored 'General case' 0 CA--C 1.499 -1.011 0 CA-C-N 115.05 -0.977 . . . . 0.0 111.146 178.565 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.628 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 33.9 t-105 -59.4 -47.03 98.87 Favored Pre-proline 0 N--CA 1.429 -1.509 0 C-N-CA 119.377 -0.929 . . . . 0.0 113.06 -176.889 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.545 ' HA ' ' HB3' ' A' ' 13' ' ' ARG . 72.3 Cg_exo -41.86 -46.02 6.75 Favored 'Trans proline' 0 N--CA 1.458 -0.572 0 C-N-CA 122.224 1.949 . . . . 0.0 112.693 -178.463 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -59.4 -37.15 77.27 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.344 0.593 . . . . 0.0 109.788 179.616 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.628 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 10.9 mt -58.76 -42.88 89.94 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.065 -0.97 . . . . 0.0 112.253 -179.095 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.45 HH11 ' HG2' ' A' ' 12' ' ' ARG . 65.5 mtt-85 -136.51 -49.3 0.65 Allowed 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 112.474 0.546 . . . . 0.0 112.474 -178.665 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.545 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 29.6 tpt180 . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.333 -0.841 . . . . 0.0 110.933 -179.688 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.882 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.54 0.591 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . 0.882 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 87.7 Cg_exo -49.23 159.37 1.15 Allowed 'Trans proline' 0 C--N 1.363 1.325 0 C-N-CA 123.194 2.596 . . . . 0.0 113.863 -179.212 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 34.2 p-90 -66.31 -32.35 73.7 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 177.531 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.62 ' CH2' ' HG2' ' A' ' 5' ' ' PRO . 11.0 p-90 -85.03 -17.3 37.94 Favored 'General case' 0 CA--C 1.499 -1.009 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.322 178.881 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.655 ' N ' ' HD2' ' A' ' 9' ' ' PRO . 25.4 t-105 -60.13 -44.82 97.4 Favored Pre-proline 0 N--CA 1.427 -1.591 0 C-N-CA 119.364 -0.934 . . . . 0.0 113.135 -176.713 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.655 ' HD2' ' N ' ' A' ' 8' ' ' TRP . 1.2 Cg_endo -45.71 -43.02 19.15 Favored 'Trans proline' 0 C--N 1.349 0.565 0 C-N-CA 121.981 1.788 . . . . 0.0 112.483 -178.453 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 -57.64 -36.4 71.8 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 178.801 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.613 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 5.4 mt -67.08 -66.19 0.59 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 114.702 -1.136 . . . . 0.0 111.469 -179.707 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 30.4 tpt180 -87.91 -57.26 3.0 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 115.936 -0.574 . . . . 0.0 112.238 -178.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 27.8 mmm180 . . . . . 0 C--O 1.25 1.086 0 CA-C-O 118.094 -0.955 . . . . 0.0 111.218 -179.339 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.835 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.539 0.521 0 N-CA-C 111.615 0.228 . . . . 0.0 111.615 . . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . 0.835 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 83.6 Cg_exo -49.8 162.88 0.59 Allowed 'Trans proline' 0 C--N 1.362 1.245 0 C-N-CA 122.939 2.426 . . . . 0.0 113.471 -179.562 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.468 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 41.5 p-90 -70.05 -32.78 71.05 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 177.413 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.618 ' CH2' ' HG2' ' A' ' 5' ' ' PRO . 10.8 p-90 -83.77 -16.71 43.72 Favored 'General case' 0 CA--C 1.497 -1.095 0 CA-C-N 114.917 -1.038 . . . . 0.0 111.369 178.842 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.654 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 33.6 t-105 -60.74 -44.54 95.45 Favored Pre-proline 0 N--CA 1.423 -1.798 0 C-N-CA 119.261 -0.976 . . . . 0.0 112.463 -177.114 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.55 ' HD3' ' O ' ' A' ' 5' ' ' PRO . 80.4 Cg_exo -43.03 -44.83 9.46 Favored 'Trans proline' 0 N--CA 1.46 -0.457 0 C-N-CA 122.268 1.979 . . . . 0.0 112.767 -178.565 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -60.94 -35.57 77.07 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.499 0.666 . . . . 0.0 109.501 179.361 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.654 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 9.8 mt -61.87 -53.04 61.3 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 114.858 -1.065 . . . . 0.0 112.235 -179.211 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 47.5 ttm-85 -117.29 -49.46 2.58 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 112.323 0.49 . . . . 0.0 112.323 -178.353 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.453 ' HD2' ' C ' ' A' ' 13' ' ' ARG . 4.5 tmm_? . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.04 -0.981 . . . . 0.0 110.916 -179.29 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.832 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.542 0.67 0 N-CA-C 111.298 0.11 . . . . 0.0 111.298 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . 0.832 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 85.4 Cg_exo -48.8 161.52 0.48 Allowed 'Trans proline' 0 C--N 1.367 1.533 0 C-N-CA 122.723 2.282 . . . . 0.0 113.431 -179.931 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.466 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 38.4 p-90 -68.22 -33.52 74.56 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 177.457 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.579 ' CH2' ' HG2' ' A' ' 5' ' ' PRO . 9.2 p-90 -82.32 -17.38 45.95 Favored 'General case' 0 CA--C 1.497 -1.092 0 CA-C-N 114.94 -1.027 . . . . 0.0 111.119 178.724 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.651 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 33.4 t-105 -58.66 -46.26 99.59 Favored Pre-proline 0 N--CA 1.427 -1.577 0 C-N-CA 119.405 -0.918 . . . . 0.0 112.408 -177.236 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.502 ' HD3' ' O ' ' A' ' 5' ' ' PRO . 81.5 Cg_exo -41.16 -46.85 5.34 Favored 'Trans proline' 0 N--CA 1.459 -0.521 0 C-N-CA 122.439 2.093 . . . . 0.0 112.661 -178.921 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.407 ' HD1' ' O ' ' A' ' 7' ' ' TRP . 7.1 m-85 -58.9 -37.15 75.97 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 179.311 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.651 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 5.9 mt -65.3 -70.28 0.24 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.749 -179.572 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 29.7 tpt180 -87.11 -56.23 3.47 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.921 -0.582 . . . . 0.0 112.184 -178.466 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.413 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 30.1 tpt180 . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.005 -0.998 . . . . 0.0 111.168 -179.547 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.862 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.541 0.607 0 N-CA-C 111.773 0.286 . . . . 0.0 111.773 . . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . 0.862 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 80.8 Cg_exo -50.21 164.45 0.47 Allowed 'Trans proline' 0 C--N 1.362 1.275 0 C-N-CA 123.041 2.494 . . . . 0.0 113.58 -179.56 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.469 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 34.1 p-90 -71.14 -33.49 70.12 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 177.392 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.628 ' CH2' ' HG2' ' A' ' 5' ' ' PRO . 10.6 p-90 -83.28 -17.22 43.36 Favored 'General case' 0 CA--C 1.496 -1.112 0 CA-C-N 114.937 -1.029 . . . . 0.0 111.374 178.866 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.663 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 29.8 t-105 -60.9 -44.31 94.35 Favored Pre-proline 0 N--CA 1.424 -1.748 0 C-N-CA 119.162 -1.015 . . . . 0.0 112.471 -176.993 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.849 ' HA ' ' HB3' ' A' ' 13' ' ' ARG . 81.3 Cg_exo -42.95 -47.53 8.21 Favored 'Trans proline' 0 N--CA 1.459 -0.516 0 C-N-CA 122.108 1.872 . . . . 0.0 112.687 -178.488 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -57.62 -36.52 71.91 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.444 0.64 . . . . 0.0 109.303 179.201 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.663 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 9.3 mt -61.35 -39.11 89.38 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 114.892 -1.049 . . . . 0.0 111.603 -179.805 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 36.5 ttm180 -150.61 -50.86 0.13 Allowed 'General case' 0 CA--C 1.529 0.164 0 N-CA-C 112.103 0.408 . . . . 0.0 112.103 -178.79 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.849 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 5.9 tpm_? . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.108 -0.949 . . . . 0.0 111.276 -179.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 30.3 m . . . . . 0 N--CA 1.485 1.296 0 CA-C-O 120.917 0.389 . . . . 0.0 111.204 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.406 ' HB3' ' CE1' ' A' ' 4' ' ' TYR . 47.9 ttm-85 -65.07 -49.96 68.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.969 179.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.406 ' HG2' HH11 ' A' ' 3' ' ' ARG . 53.2 ttt-85 -174.9 -38.98 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.056 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.852 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -59.39 -169.53 0.02 OUTLIER Pre-proline 0 CA--C 1.541 0.624 0 CA-C-N 116.278 -0.419 . . . . 0.0 112.093 -179.532 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.852 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 99.6 Cg_exo -48.78 163.13 0.31 Allowed 'Trans proline' 0 C--N 1.363 1.342 0 C-N-CA 122.942 2.428 . . . . 0.0 113.557 -179.579 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.447 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 35.9 p-90 -70.09 -33.53 72.0 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 177.541 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.617 ' CH2' ' HG2' ' A' ' 5' ' ' PRO . 11.6 p-90 -83.76 -16.88 43.11 Favored 'General case' 0 CA--C 1.498 -1.054 0 CA-C-N 114.845 -1.07 . . . . 0.0 111.566 178.923 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.669 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 29.0 t-105 -61.05 -44.84 95.7 Favored Pre-proline 0 N--CA 1.426 -1.663 0 C-N-CA 119.271 -0.972 . . . . 0.0 112.548 -176.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.78 ' HA ' ' HB3' ' A' ' 13' ' ' ARG . 81.8 Cg_exo -43.36 -47.48 9.01 Favored 'Trans proline' 0 N--CA 1.46 -0.493 0 C-N-CA 122.129 1.886 . . . . 0.0 112.87 -178.404 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -58.04 -35.23 71.0 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.463 0.649 . . . . 0.0 109.329 179.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.669 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 9.6 mt -62.25 -41.31 98.33 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 114.889 -1.051 . . . . 0.0 111.766 -179.613 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.401 HH11 ' HG2' ' A' ' 12' ' ' ARG . 53.4 ttt-85 -146.2 -47.79 0.2 Allowed 'General case' 0 CA--C 1.529 0.145 0 N-CA-C 112.257 0.466 . . . . 0.0 112.257 -178.523 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.78 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 3.3 tmt_? -71.64 33.93 0.05 Allowed 'General case' 0 C--O 1.249 1.028 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.891 -179.4 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.273 1 O-C-N 78.809 -27.432 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . 0.406 HG22 ' H2 ' ' A' ' 1' ' ' VAL . 27.8 m . . . . . 0 N--CA 1.486 1.339 0 CA-C-O 120.945 0.402 . . . . 0.0 111.276 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.507 ' HB2' HH11 ' A' ' 13' ' ' ARG . 0.0 OUTLIER -62.27 -48.68 78.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.432 179.879 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 79.3 ttt180 -174.42 -41.49 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.759 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.861 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -60.75 -167.8 0.02 OUTLIER Pre-proline 0 CA--C 1.542 0.672 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.903 -179.796 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.861 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 92.0 Cg_exo -48.53 156.8 1.65 Allowed 'Trans proline' 0 C--N 1.364 1.376 0 C-N-CA 122.736 2.291 . . . . 0.0 113.511 -179.616 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 35.3 p-90 -64.35 -32.0 73.44 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 177.669 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.593 ' CH2' ' HG2' ' A' ' 5' ' ' PRO . 11.4 p-90 -84.99 -17.62 37.03 Favored 'General case' 0 CA--C 1.499 -0.989 0 CA-C-N 115.13 -0.941 . . . . 0.0 111.591 179.074 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.664 ' N ' ' HD2' ' A' ' 9' ' ' PRO . 26.4 t-105 -60.18 -44.15 95.61 Favored Pre-proline 0 N--CA 1.428 -1.559 0 C-N-CA 119.291 -0.964 . . . . 0.0 113.293 -176.576 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.806 ' HA ' ' HB3' ' A' ' 13' ' ' ARG . 2.1 Cg_endo -46.68 -44.55 21.5 Favored 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.05 1.834 . . . . 0.0 112.758 -178.231 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -59.78 -33.94 72.35 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 179.135 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.644 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 11.9 mt -62.28 -44.19 97.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 114.952 -1.022 . . . . 0.0 112.138 -179.498 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 79.5 ttt180 -139.57 -46.21 0.45 Allowed 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 112.222 0.452 . . . . 0.0 112.222 -178.438 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.806 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 11.7 tpt180 -70.85 34.7 0.05 OUTLIER 'General case' 0 C--O 1.249 1.036 0 CA-C-O 118.098 -0.953 . . . . 0.0 111.389 -179.722 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.342 1 O-C-N 85.39 -23.319 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . 0.437 ' O ' HG12 ' A' ' 1' ' ' VAL . 8.0 p . . . . . 0 N--CA 1.485 1.323 0 CA-C-O 120.799 0.333 . . . . 0.0 111.087 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -61.53 138.74 58.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.021 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 14.8 tpp85 -168.67 -43.29 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.152 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.843 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -63.97 -168.16 0.03 OUTLIER Pre-proline 0 CA--C 1.542 0.641 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.528 179.884 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.843 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 83.1 Cg_exo -49.34 161.66 0.65 Allowed 'Trans proline' 0 C--N 1.363 1.331 0 C-N-CA 122.793 2.329 . . . . 0.0 113.371 -179.804 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.487 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 40.1 p-90 -68.64 -33.69 74.45 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 108.069 -1.085 . . . . 0.0 108.069 177.425 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.594 ' CH2' ' HG2' ' A' ' 5' ' ' PRO . 11.4 p-90 -82.55 -15.48 52.16 Favored 'General case' 0 CA--C 1.495 -1.144 0 CA-C-N 114.883 -1.053 . . . . 0.0 111.311 178.749 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.649 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 29.5 t-105 -61.56 -45.46 93.78 Favored Pre-proline 0 N--CA 1.425 -1.707 0 C-N-CA 119.355 -0.938 . . . . 0.0 112.741 -176.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.549 ' HD3' ' O ' ' A' ' 5' ' ' PRO . 82.3 Cg_exo -43.8 -44.14 11.68 Favored 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.234 1.956 . . . . 0.0 112.905 -178.511 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -61.64 -34.83 76.38 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.384 0.611 . . . . 0.0 109.595 179.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.649 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 12.5 mt -59.47 -46.62 88.26 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 114.958 -1.019 . . . . 0.0 112.196 -179.297 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.473 ' C ' ' HN2' ' A' ' 14' ' ' NH2 . 43.3 mtp85 -129.69 -47.49 1.15 Allowed 'General case' 0 C--N 1.332 -0.155 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -178.698 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.414 ' HB2' ' HA ' ' A' ' 9' ' ' PRO . 40.0 mmm-85 -68.46 19.35 0.03 OUTLIER 'General case' 0 C--O 1.25 1.107 0 CA-C-O 118.116 -0.945 . . . . 0.0 110.741 -179.927 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' NH2 . . . . . 0.473 ' HN2' ' C ' ' A' ' 12' ' ' ARG . . . . . . . . 0 C--N 1.33 -0.257 0 CA-C-N 119.176 0.898 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . 0.414 ' H3 ' HG22 ' A' ' 1' ' ' VAL . 27.8 m . . . . . 0 N--CA 1.485 1.295 0 CA-C-O 120.862 0.363 . . . . 0.0 111.23 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.409 ' HB2' ' CZ ' ' A' ' 4' ' ' TYR . 97.8 mtt180 -57.18 140.39 49.72 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.293 -179.658 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 82.0 mtm180 -95.6 135.51 37.17 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.609 179.675 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.876 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -162.94 -169.1 0.21 Allowed Pre-proline 0 CA--C 1.54 0.587 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 179.753 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.876 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 97.0 Cg_exo -48.7 166.94 0.13 Allowed 'Trans proline' 0 C--N 1.365 1.431 0 C-N-CA 123.08 2.52 . . . . 0.0 113.635 -179.429 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.444 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 33.9 p-90 -72.75 -34.27 66.91 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 177.43 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.647 ' CH2' ' HG2' ' A' ' 5' ' ' PRO . 10.9 p-90 -83.19 -17.33 43.23 Favored 'General case' 0 CA--C 1.498 -1.041 0 CA-C-N 114.813 -1.085 . . . . 0.0 111.604 178.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.661 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 26.8 t-105 -61.57 -45.25 93.7 Favored Pre-proline 0 N--CA 1.425 -1.71 0 C-N-CA 119.279 -0.969 . . . . 0.0 112.612 -176.938 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.565 ' HA ' ' HB3' ' A' ' 13' ' ' ARG . 99.8 Cg_exo -42.73 -43.34 8.83 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.444 2.096 . . . . 0.0 113.098 -178.333 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 4.7 m-85 -63.48 -35.42 80.38 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.478 0.656 . . . . 0.0 109.603 179.404 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.661 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 10.7 mt -60.33 -50.91 71.76 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.839 -1.073 . . . . 0.0 112.387 -179.198 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 44.2 ttt85 -125.27 -46.71 1.77 Allowed 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -178.239 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.565 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 12.0 tpt180 -63.23 4.97 0.17 Allowed 'General case' 0 C--O 1.249 1.043 0 CA-C-O 118.005 -0.998 . . . . 0.0 111.276 -179.438 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.343 1 O-C-N 87.176 -22.202 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . 0.491 HG11 HH11 ' A' ' 2' ' ' ARG . 7.6 p . . . . . 0 N--CA 1.485 1.32 0 CA-C-O 120.616 0.246 . . . . 0.0 111.13 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.491 HH11 HG11 ' A' ' 1' ' ' VAL . 54.9 mmt-85 -60.02 -42.38 94.19 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.464 -0.335 . . . . 0.0 110.763 179.804 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 39.4 ttm180 -56.22 135.56 53.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.559 179.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.872 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -138.38 -163.7 0.06 OUTLIER Pre-proline 0 CA--C 1.541 0.619 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.129 -179.697 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.872 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 93.4 Cg_exo -47.96 157.77 1.01 Allowed 'Trans proline' 0 C--N 1.366 1.488 0 C-N-CA 122.438 2.092 . . . . 0.0 113.057 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.488 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 42.0 p-90 -64.93 -33.14 75.33 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 177.62 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.543 ' CH2' ' HG2' ' A' ' 5' ' ' PRO . 11.9 p-90 -83.19 -14.56 53.13 Favored 'General case' 0 CA--C 1.497 -1.058 0 CA-C-N 115.009 -0.996 . . . . 0.0 111.439 178.734 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.633 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 32.6 t-105 -61.35 -45.81 94.88 Favored Pre-proline 0 N--CA 1.427 -1.597 0 C-N-CA 119.195 -1.002 . . . . 0.0 112.352 -177.273 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.55 ' HD3' ' O ' ' A' ' 5' ' ' PRO . 85.1 Cg_exo -43.97 -44.13 12.17 Favored 'Trans proline' 0 C--N 1.348 0.508 0 C-N-CA 122.111 1.874 . . . . 0.0 112.314 -178.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -59.75 -36.95 77.68 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 179.137 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.633 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 9.3 mt -63.15 -68.15 0.36 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 114.983 -1.008 . . . . 0.0 111.637 -179.704 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.548 ' HG3' ' HE1' ' A' ' 8' ' ' TRP . 13.4 mmp_? -92.4 -55.59 3.35 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -178.799 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.409 HH11 ' HG3' ' A' ' 13' ' ' ARG . 32.4 tpt85 -62.84 3.42 0.23 Allowed 'General case' 0 C--O 1.249 1.052 0 CA-C-O 117.966 -1.016 . . . . 0.0 111.32 -179.258 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.341 1 O-C-N 96.323 -16.486 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 14.5 p . . . . . 0 N--CA 1.486 1.329 0 CA-C-O 121.415 0.626 . . . . 0.0 110.618 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 30.7 tpt180 -174.54 -53.11 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.752 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 39.4 mmt180 -93.87 37.8 1.08 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.036 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.82 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -65.13 -168.98 0.04 OUTLIER Pre-proline 0 CA--C 1.54 0.586 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.638 -179.899 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.82 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 79.9 Cg_exo -49.59 160.46 1.07 Allowed 'Trans proline' 0 C--N 1.364 1.351 0 C-N-CA 122.773 2.315 . . . . 0.0 113.333 -179.751 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.502 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 32.4 p-90 -67.82 -33.11 74.15 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 177.401 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.601 ' CH2' ' HG2' ' A' ' 5' ' ' PRO . 10.9 p-90 -83.01 -15.91 49.24 Favored 'General case' 0 CA--C 1.496 -1.117 0 CA-C-N 114.985 -1.007 . . . . 0.0 111.233 178.748 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.636 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 29.4 t-105 -61.2 -44.8 94.79 Favored Pre-proline 0 N--CA 1.426 -1.666 0 C-N-CA 119.408 -0.917 . . . . 0.0 112.649 -177.088 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.569 ' HD3' ' O ' ' A' ' 5' ' ' PRO . 88.5 Cg_exo -42.91 -45.68 8.95 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.316 2.011 . . . . 0.0 112.758 -178.653 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 7.4 m-85 -59.23 -36.31 75.21 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.399 0.618 . . . . 0.0 109.392 179.285 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.636 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 7.5 mt -64.01 -70.17 0.24 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.959 -1.018 . . . . 0.0 111.665 -179.668 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 54.4 ttt-85 -86.92 -56.32 3.44 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 115.94 -0.573 . . . . 0.0 112.067 -178.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.409 ' HG3' HH11 ' A' ' 13' ' ' ARG . 43.7 mmm-85 -66.83 3.45 1.05 Allowed 'General case' 0 C--O 1.249 1.078 0 CA-C-O 118.089 -0.958 . . . . 0.0 111.282 -179.465 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.333 1 O-C-N 102.107 -12.871 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 57.6 t . . . . . 0 N--CA 1.485 1.318 0 CA-C-O 120.844 0.354 . . . . 0.0 110.986 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.439 ' HD3' ' N ' ' A' ' 2' ' ' ARG . 0.7 OUTLIER -76.12 148.63 37.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.935 179.748 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.415 ' HG2' HH11 ' A' ' 3' ' ' ARG . 51.6 ttt-85 -161.39 -45.92 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.181 179.888 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.874 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -64.89 -167.09 0.03 OUTLIER Pre-proline 0 CA--C 1.542 0.64 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.131 179.533 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.874 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 88.3 Cg_exo -48.99 154.41 3.29 Favored 'Trans proline' 0 C--N 1.363 1.302 0 C-N-CA 122.579 2.186 . . . . 0.0 113.209 -179.786 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 42.6 p-90 -61.83 -32.58 72.91 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 177.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.562 ' CH2' ' HG2' ' A' ' 5' ' ' PRO . 11.9 p-90 -84.57 -17.32 39.18 Favored 'General case' 0 CA--C 1.499 -0.991 0 CA-C-N 115.05 -0.977 . . . . 0.0 111.814 179.074 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.66 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 25.8 t-105 -60.3 -44.96 97.45 Favored Pre-proline 0 N--CA 1.428 -1.552 0 C-N-CA 119.254 -0.978 . . . . 0.0 113.548 -176.461 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.659 ' HD2' ' N ' ' A' ' 8' ' ' TRP . 1.2 Cg_endo -45.67 -44.28 17.78 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.175 1.916 . . . . 0.0 112.802 -178.099 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -60.94 -33.74 73.64 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.371 0.605 . . . . 0.0 109.463 179.279 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.66 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 12.9 mt -60.85 -49.17 78.57 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 114.955 -1.02 . . . . 0.0 112.262 -179.198 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 79.3 ttt180 -130.11 -46.26 1.12 Allowed 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -178.336 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.514 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 28.5 tpt180 -71.02 19.3 0.05 Allowed 'General case' 0 C--O 1.249 1.033 0 CA-C-O 118.335 -0.841 . . . . 0.0 111.526 -179.171 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.308 1 O-C-N 99.977 -14.202 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 11.6 p . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 120.799 0.333 . . . . 0.0 110.979 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 78.5 ttt180 -170.14 134.69 1.26 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.771 -179.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.565 ' HA ' ' NE ' ' A' ' 3' ' ' ARG . 5.6 tpm_? -168.31 43.97 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.044 0.45 . . . . 0.0 111.18 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.831 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -165.32 -170.91 0.24 Allowed Pre-proline 0 CA--C 1.539 0.531 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.585 179.133 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.831 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 80.9 Cg_exo -49.98 164.36 0.43 Allowed 'Trans proline' 0 C--N 1.362 1.239 0 C-N-CA 123.065 2.51 . . . . 0.0 113.708 -179.421 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.485 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 34.5 p-90 -71.03 -33.51 70.38 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 177.348 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.625 ' CH2' ' HG2' ' A' ' 5' ' ' PRO . 10.7 p-90 -83.18 -15.93 48.61 Favored 'General case' 0 CA--C 1.497 -1.081 0 CA-C-N 114.836 -1.074 . . . . 0.0 111.2 178.622 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.666 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 29.1 t-105 -61.61 -44.81 92.86 Favored Pre-proline 0 N--CA 1.426 -1.657 0 C-N-CA 119.281 -0.968 . . . . 0.0 112.42 -177.159 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.545 ' HD3' ' O ' ' A' ' 5' ' ' PRO . 80.7 Cg_exo -43.17 -44.66 9.83 Favored 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 122.308 2.005 . . . . 0.0 112.459 -178.606 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -59.93 -37.74 80.35 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 179.134 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.666 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 6.9 mt -63.34 -68.58 0.33 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 114.951 -1.022 . . . . 0.0 111.513 -179.79 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 12.1 tpt180 -86.12 -59.0 2.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.79 -0.641 . . . . 0.0 112.028 -178.735 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.468 ' HE ' ' HH ' ' A' ' 4' ' ' TYR . 37.0 mmt180 -71.47 51.07 0.18 Allowed 'General case' 0 C--O 1.249 1.049 0 CA-C-O 118.083 -0.96 . . . . 0.0 111.424 -179.209 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.376 1 O-C-N 110.765 -7.459 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 7.5 p . . . . . 0 N--CA 1.485 1.303 0 CA-C-O 120.8 0.333 . . . . 0.0 111.136 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.417 ' HG2' HH11 ' A' ' 2' ' ' ARG . 11.8 tpt180 -170.76 -46.72 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.872 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.436 ' HG3' ' O ' ' A' ' 3' ' ' ARG . 10.5 tpt180 -87.67 35.47 0.73 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.714 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.876 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -71.65 -168.23 0.08 OUTLIER Pre-proline 0 CA--C 1.54 0.576 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.339 179.938 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.876 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 97.9 Cg_exo -48.23 156.1 1.73 Allowed 'Trans proline' 0 C--N 1.364 1.349 0 C-N-CA 122.669 2.246 . . . . 0.0 113.328 -179.649 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 38.6 p-90 -63.55 -31.59 72.8 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 177.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.593 ' CH2' ' HG2' ' A' ' 5' ' ' PRO . 11.5 p-90 -85.61 -18.0 34.57 Favored 'General case' 0 CA--C 1.499 -0.989 0 CA-C-N 115.088 -0.96 . . . . 0.0 111.75 179.086 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.655 ' N ' ' HD2' ' A' ' 9' ' ' PRO . 25.6 t-105 -59.8 -44.27 96.79 Favored Pre-proline 0 N--CA 1.428 -1.532 0 C-N-CA 119.349 -0.94 . . . . 0.0 113.156 -176.598 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.655 ' HD2' ' N ' ' A' ' 8' ' ' TRP . 1.8 Cg_endo -46.96 -43.91 23.65 Favored 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 121.934 1.756 . . . . 0.0 112.34 -178.41 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -58.7 -35.1 72.1 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 178.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.626 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 9.1 mt -65.45 -70.07 0.26 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 114.793 -1.094 . . . . 0.0 111.551 -179.694 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 78.3 ttt180 -86.75 -56.2 3.51 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.953 -0.567 . . . . 0.0 112.006 -179.074 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.481 ' HE ' ' HH ' ' A' ' 4' ' ' TYR . 37.5 mmt180 -70.09 17.05 0.06 Allowed 'General case' 0 C--O 1.25 1.093 0 CA-C-O 118.076 -0.964 . . . . 0.0 111.499 -179.182 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.365 0 O-C-N 120.841 -1.162 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 18.1 t . . . . . 0 N--CA 1.485 1.298 0 CA-C-O 121.235 0.541 . . . . 0.0 110.741 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 78.4 ttt180 -67.33 145.99 54.55 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.965 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 78.5 ttt180 -168.21 -46.26 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.218 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.879 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -68.06 -170.03 0.08 OUTLIER Pre-proline 0 CA--C 1.541 0.626 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.874 179.902 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.879 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 88.7 Cg_exo -50.74 159.66 2.19 Favored 'Trans proline' 0 C--N 1.361 1.211 0 C-N-CA 123.095 2.53 . . . . 0.0 113.721 -179.466 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 45.8 p-90 -66.93 -31.4 71.96 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 177.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.606 ' CH2' ' HG2' ' A' ' 5' ' ' PRO . 10.6 p-90 -85.67 -17.37 36.24 Favored 'General case' 0 CA--C 1.496 -1.1 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.468 179.059 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.684 ' N ' ' HD2' ' A' ' 9' ' ' PRO . 25.2 t-105 -60.2 -43.9 94.89 Favored Pre-proline 0 N--CA 1.424 -1.735 0 C-N-CA 119.11 -1.036 . . . . 0.0 113.048 -176.871 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.684 ' HD2' ' N ' ' A' ' 8' ' ' TRP . 1.8 Cg_endo -46.09 -43.13 20.83 Favored 'Trans proline' 0 N--CA 1.459 -0.51 0 C-N-CA 122.169 1.913 . . . . 0.0 112.625 -178.355 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 -61.66 -33.72 74.46 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.424 0.63 . . . . 0.0 109.31 179.162 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.672 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 12.8 mt -61.56 -48.19 82.11 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 114.929 -1.032 . . . . 0.0 112.188 -179.383 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 56.6 ttp85 -127.88 -48.17 1.37 Allowed 'General case' 0 C--O 1.231 0.126 0 N-CA-C 111.976 0.362 . . . . 0.0 111.976 -178.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.55 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 29.7 tpt180 -67.43 17.89 0.03 OUTLIER 'General case' 0 C--O 1.249 1.045 0 CA-C-O 118.081 -0.962 . . . . 0.0 111.377 -179.686 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.33 1 O-C-N 95.13 -17.231 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . 0.401 HG11 ' O ' ' A' ' 1' ' ' VAL . 8.7 p . . . . . 0 N--CA 1.485 1.303 0 CA-C-O 120.837 0.351 . . . . 0.0 111.034 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 59.4 mtt85 -58.26 128.62 38.08 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.872 -179.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 45.5 mmm-85 -109.37 137.28 47.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.763 179.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.826 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -157.17 -163.81 0.08 OUTLIER Pre-proline 0 CA--C 1.541 0.622 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.083 -179.68 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.826 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 96.4 Cg_exo -48.03 158.15 0.95 Allowed 'Trans proline' 0 C--N 1.367 1.51 0 C-N-CA 122.527 2.151 . . . . 0.0 113.092 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.469 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 39.3 p-90 -65.07 -33.38 75.9 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 177.641 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.585 ' CH2' ' HG2' ' A' ' 5' ' ' PRO . 12.1 p-90 -83.44 -15.82 48.15 Favored 'General case' 0 CA--C 1.497 -1.067 0 CA-C-N 115.117 -0.947 . . . . 0.0 111.541 178.93 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.632 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 32.9 t-105 -60.63 -44.74 96.28 Favored Pre-proline 0 N--CA 1.426 -1.656 0 C-N-CA 119.284 -0.967 . . . . 0.0 112.446 -177.105 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.843 ' HA ' ' HB3' ' A' ' 13' ' ' ARG . 84.3 Cg_exo -43.66 -47.53 9.51 Favored 'Trans proline' 0 N--CA 1.458 -0.562 0 C-N-CA 122.103 1.869 . . . . 0.0 112.621 -178.859 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -56.77 -35.48 68.73 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.443 0.639 . . . . 0.0 109.517 179.262 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.632 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 10.1 mt -62.21 -43.83 97.95 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 114.882 -1.054 . . . . 0.0 111.874 -179.312 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.41 ' C ' ' HN2' ' A' ' 14' ' ' NH2 . 74.5 mtp180 -141.77 -48.91 0.38 Allowed 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -178.825 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.843 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 0.0 OUTLIER -68.66 23.55 0.03 OUTLIER 'General case' 0 C--O 1.249 1.04 0 CA-C-O 118.034 -0.984 . . . . 0.0 110.637 -179.694 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' NH2 . . . . . 0.41 ' HN2' ' C ' ' A' ' 12' ' ' ARG . . . . . . . . 0 C--N 1.329 -0.314 1 O-C-N 90.937 -19.852 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . 0.486 ' H3 ' ' HD3' ' A' ' 13' ' ' ARG . 35.9 m . . . . . 0 N--CA 1.487 1.376 0 CA-C-O 120.756 0.312 . . . . 0.0 111.212 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.497 ' HB2' ' CE2' ' A' ' 4' ' ' TYR . 98.9 mtt180 -58.65 151.18 21.38 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.148 -179.775 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.529 ' N ' ' HD2' ' A' ' 3' ' ' ARG . 7.1 mpt_? -87.17 43.74 1.12 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.429 -179.52 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.845 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -64.34 -167.6 0.03 OUTLIER Pre-proline 0 CA--C 1.542 0.655 0 C-N-CA 120.952 -0.299 . . . . 0.0 111.391 -179.952 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.845 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 81.0 Cg_exo -48.9 158.14 1.36 Allowed 'Trans proline' 0 C--N 1.365 1.399 0 C-N-CA 122.635 2.223 . . . . 0.0 113.342 -179.794 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.44 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 39.4 p-90 -65.48 -33.68 76.5 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 177.564 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.561 ' CH2' ' HG2' ' A' ' 5' ' ' PRO . 9.9 p-90 -81.93 -17.69 46.23 Favored 'General case' 0 CA--C 1.497 -1.09 0 CA-C-N 115.078 -0.964 . . . . 0.0 111.178 178.557 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.647 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 35.4 t-105 -57.41 -46.49 99.8 Favored Pre-proline 0 N--CA 1.428 -1.546 0 C-N-CA 119.518 -0.873 . . . . 0.0 112.781 -176.948 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.888 ' HA ' ' HB3' ' A' ' 13' ' ' ARG . 89.2 Cg_exo -41.31 -49.63 4.79 Favored 'Trans proline' 0 N--CA 1.458 -0.58 0 C-N-CA 122.266 1.977 . . . . 0.0 112.979 -178.546 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -57.68 -35.75 71.0 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.344 0.592 . . . . 0.0 109.695 179.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.647 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 10.1 mt -59.68 -41.53 90.87 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.829 -179.538 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.432 ' C ' ' HN2' ' A' ' 14' ' ' NH2 . 72.4 mtt-85 -146.16 -48.12 0.2 Allowed 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 112.381 0.512 . . . . 0.0 112.381 -178.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.888 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 30.7 tpt180 -66.29 17.65 0.02 OUTLIER 'General case' 0 C--O 1.249 1.06 0 CA-C-O 118.039 -0.981 . . . . 0.0 110.927 -179.623 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' NH2 . . . . . 0.432 ' HN2' ' C ' ' A' ' 12' ' ' ARG . . . . . . . . 0 C--N 1.329 -0.294 1 O-C-N 89.022 -21.049 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . 0.58 HG12 ' N ' ' A' ' 2' ' ' ARG . 8.6 p . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.708 0.29 . . . . 0.0 111.122 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.58 ' N ' HG12 ' A' ' 1' ' ' VAL . 37.7 ptt180 -60.39 139.5 57.65 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.278 -179.877 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 9.8 ptp180 -167.4 42.82 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.86 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.868 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -143.58 -166.28 0.12 Allowed Pre-proline 0 CA--C 1.541 0.598 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.313 179.843 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.868 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 90.9 Cg_exo -48.78 162.77 0.34 Allowed 'Trans proline' 0 C--N 1.365 1.396 0 C-N-CA 122.731 2.287 . . . . 0.0 113.429 -179.74 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.477 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 33.3 p-90 -69.31 -33.44 73.16 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 177.542 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.619 ' CH2' ' HG2' ' A' ' 5' ' ' PRO . 11.3 p-90 -83.65 -16.0 46.75 Favored 'General case' 0 CA--C 1.498 -1.04 0 CA-C-N 114.945 -1.025 . . . . 0.0 111.359 178.777 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.648 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 29.1 t-105 -61.32 -44.18 92.17 Favored Pre-proline 0 N--CA 1.426 -1.645 0 C-N-CA 119.336 -0.945 . . . . 0.0 112.611 -177.016 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.569 ' HD3' ' O ' ' A' ' 5' ' ' PRO . 86.2 Cg_exo -43.46 -49.4 7.66 Favored 'Trans proline' 0 N--CA 1.46 -0.491 0 C-N-CA 122.174 1.916 . . . . 0.0 112.541 -178.649 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 7.4 m-85 -56.16 -35.35 67.09 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 179.208 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.648 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 6.8 mt -65.93 -70.58 0.23 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.09 -0.959 . . . . 0.0 111.51 -179.795 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.574 ' HA ' ' HE ' ' A' ' 12' ' ' ARG . 5.3 tpm_? -83.08 -57.51 3.25 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.987 -178.809 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 29.0 tpt180 -63.22 -3.43 1.85 Allowed 'General case' 0 C--O 1.249 1.062 0 CA-C-O 118.297 -0.859 . . . . 0.0 111.029 -179.386 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.311 1 O-C-N 82.269 -25.27 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 12.2 p . . . . . 0 N--CA 1.485 1.299 0 CA-C-O 120.853 0.358 . . . . 0.0 111.099 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 57.6 ttp85 -68.7 134.1 49.36 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.45 179.629 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 9.6 ptp180 -169.1 43.25 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.924 0.392 . . . . 0.0 111.287 -179.733 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.857 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -149.44 -163.75 0.07 OUTLIER Pre-proline 0 CA--C 1.541 0.612 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.884 179.542 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.857 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 94.0 Cg_exo -48.01 155.8 1.66 Allowed 'Trans proline' 0 C--N 1.367 1.527 0 C-N-CA 122.377 2.051 . . . . 0.0 113.067 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.432 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 31.0 p-90 -63.46 -33.8 76.37 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 177.53 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.514 ' CH2' ' HG2' ' A' ' 5' ' ' PRO . 9.7 p-90 -81.39 -16.78 51.15 Favored 'General case' 0 CA--C 1.499 -0.981 0 CA-C-N 114.986 -1.006 . . . . 0.0 111.278 178.618 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.642 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 37.6 t-105 -59.18 -47.25 98.75 Favored Pre-proline 0 N--CA 1.431 -1.378 0 C-N-CA 119.358 -0.937 . . . . 0.0 112.911 -176.822 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.463 ' HD3' ' O ' ' A' ' 5' ' ' PRO . 83.4 Cg_exo -41.33 -44.29 5.71 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.445 2.097 . . . . 0.0 112.704 -178.54 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -61.49 -37.39 83.48 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 179.38 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.642 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 8.0 mt -63.54 -68.55 0.34 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 114.976 -1.011 . . . . 0.0 112.052 -179.415 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.546 ' NE ' ' HA ' ' A' ' 12' ' ' ARG . 5.4 tpm_? -91.13 -55.55 3.49 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.028 -0.533 . . . . 0.0 112.362 -178.163 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 36.5 mmt180 -70.64 24.16 0.04 OUTLIER 'General case' 0 C--O 1.248 1.022 0 CA-C-O 118.063 -0.97 . . . . 0.0 111.483 -179.213 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.358 0 CA-C-N 119.422 1.01 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 7.5 p . . . . . 0 N--CA 1.485 1.324 0 CA-C-O 120.85 0.357 . . . . 0.0 111.217 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 55.1 ttp180 -167.89 -33.88 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.172 179.749 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.459 ' C ' ' HD3' ' A' ' 3' ' ' ARG . 4.1 tmt_? -51.34 130.22 26.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.67 0.271 . . . . 0.0 110.351 -179.977 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.871 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -140.51 -168.66 0.19 Allowed Pre-proline 0 CA--C 1.541 0.631 0 N-CA-C 112.016 0.376 . . . . 0.0 112.016 -179.626 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.871 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 87.9 Cg_exo -50.56 163.12 0.75 Allowed 'Trans proline' 0 C--N 1.364 1.383 0 C-N-CA 123.13 2.553 . . . . 0.0 113.83 -179.478 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.447 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 33.0 p-90 -69.89 -34.49 73.62 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 177.33 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.613 ' CH2' ' HG2' ' A' ' 5' ' ' PRO . 10.1 p-90 -81.59 -17.51 48.02 Favored 'General case' 0 CA--C 1.496 -1.117 0 CA-C-N 114.976 -1.011 . . . . 0.0 111.11 178.591 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.636 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 42.8 t-105 -58.44 -46.25 99.63 Favored Pre-proline 0 N--CA 1.425 -1.712 0 C-N-CA 119.215 -0.994 . . . . 0.0 112.552 -177.113 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.842 ' HA ' ' HB3' ' A' ' 13' ' ' ARG . 74.3 Cg_exo -40.54 -50.81 3.69 Favored 'Trans proline' 0 N--CA 1.456 -0.684 0 C-N-CA 122.317 2.012 . . . . 0.0 112.766 -178.467 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -55.09 -37.11 66.38 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.38 0.609 . . . . 0.0 109.373 179.445 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.636 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 7.1 mt -62.88 -40.54 97.84 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.067 -0.97 . . . . 0.0 111.225 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 43.3 ttt85 -150.48 -51.59 0.14 Allowed 'General case' 0 CA--C 1.53 0.173 0 N-CA-C 112.002 0.371 . . . . 0.0 112.002 -179.016 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.842 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 12.1 tpt180 -73.34 47.6 0.22 Allowed 'General case' 0 C--O 1.249 1.044 0 CA-C-O 118.06 -0.972 . . . . 0.0 111.179 -179.723 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.311 1 O-C-N 85.524 -23.235 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . 0.415 ' H3 ' HG22 ' A' ' 1' ' ' VAL . 55.4 t . . . . . 0 N--CA 1.485 1.283 0 CA-C-O 120.784 0.326 . . . . 0.0 111.045 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 40.0 ttm180 -170.23 -40.17 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.126 179.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 25.6 mtm105 -46.88 138.25 6.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.882 0.372 . . . . 0.0 111.577 -179.386 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.832 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -146.19 -165.38 0.1 Allowed Pre-proline 0 CA--C 1.542 0.664 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.004 179.706 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.832 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 82.4 Cg_exo -49.11 157.23 1.89 Allowed 'Trans proline' 0 C--N 1.366 1.489 0 C-N-CA 122.544 2.162 . . . . 0.0 113.316 -179.801 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.444 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 35.2 p-90 -64.44 -33.97 77.1 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 177.54 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.579 ' CE3' HD12 ' A' ' 11' ' ' LEU . 9.8 p-90 -81.68 -16.21 52.02 Favored 'General case' 0 CA--C 1.499 -1.011 0 CA-C-N 115.05 -0.977 . . . . 0.0 111.146 178.565 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.628 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 33.9 t-105 -59.4 -47.03 98.87 Favored Pre-proline 0 N--CA 1.429 -1.509 0 C-N-CA 119.377 -0.929 . . . . 0.0 113.06 -176.889 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.545 ' HA ' ' HB3' ' A' ' 13' ' ' ARG . 72.3 Cg_exo -41.86 -46.02 6.75 Favored 'Trans proline' 0 N--CA 1.458 -0.572 0 C-N-CA 122.224 1.949 . . . . 0.0 112.693 -178.463 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -59.4 -37.15 77.27 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.344 0.593 . . . . 0.0 109.788 179.616 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.628 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 10.9 mt -58.76 -42.88 89.94 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.065 -0.97 . . . . 0.0 112.253 -179.095 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.45 HH11 ' HG2' ' A' ' 12' ' ' ARG . 65.5 mtt-85 -136.51 -49.3 0.65 Allowed 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 112.474 0.546 . . . . 0.0 112.474 -178.665 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.545 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 29.6 tpt180 -64.84 6.94 0.19 Allowed 'General case' 0 C--O 1.249 1.031 0 CA-C-O 118.333 -0.841 . . . . 0.0 110.933 -179.688 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.325 1 O-C-N 87.761 -21.837 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 27.7 m . . . . . 0 N--CA 1.486 1.327 0 CA-C-O 120.817 0.342 . . . . 0.0 111.282 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 60.8 mtt85 -52.11 131.74 32.36 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.528 179.797 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 27.1 ttt85 -173.95 45.93 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.967 0.413 . . . . 0.0 110.757 -179.379 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.882 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -161.4 -169.17 0.22 Allowed Pre-proline 0 CA--C 1.54 0.591 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -179.769 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.882 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 87.7 Cg_exo -49.23 159.37 1.15 Allowed 'Trans proline' 0 C--N 1.363 1.325 0 C-N-CA 123.194 2.596 . . . . 0.0 113.863 -179.212 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 34.2 p-90 -66.31 -32.35 73.7 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 177.531 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.62 ' CH2' ' HG2' ' A' ' 5' ' ' PRO . 11.0 p-90 -85.03 -17.3 37.94 Favored 'General case' 0 CA--C 1.499 -1.009 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.322 178.881 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.655 ' N ' ' HD2' ' A' ' 9' ' ' PRO . 25.4 t-105 -60.13 -44.82 97.4 Favored Pre-proline 0 N--CA 1.427 -1.591 0 C-N-CA 119.364 -0.934 . . . . 0.0 113.135 -176.713 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.655 ' HD2' ' N ' ' A' ' 8' ' ' TRP . 1.2 Cg_endo -45.71 -43.02 19.15 Favored 'Trans proline' 0 C--N 1.349 0.565 0 C-N-CA 121.981 1.788 . . . . 0.0 112.483 -178.453 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 -57.64 -36.4 71.8 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 178.801 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.613 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 5.4 mt -67.08 -66.19 0.59 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 114.702 -1.136 . . . . 0.0 111.469 -179.707 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 30.4 tpt180 -87.91 -57.26 3.0 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 115.936 -0.574 . . . . 0.0 112.238 -178.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 27.8 mmm180 -62.59 -6.12 3.22 Favored 'General case' 0 C--O 1.25 1.086 0 CA-C-O 118.094 -0.955 . . . . 0.0 111.218 -179.339 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 119.662 1.119 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 47.5 t . . . . . 0 N--CA 1.485 1.31 0 CA-C-O 120.735 0.303 . . . . 0.0 110.989 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.483 ' HG2' HH11 ' A' ' 2' ' ' ARG . 62.2 mtt-85 -78.57 40.47 0.37 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.294 -179.917 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 29.1 tpt180 -66.4 136.26 55.49 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.497 -0.319 . . . . 0.0 110.609 179.567 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.835 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -143.84 -168.56 0.19 Allowed Pre-proline 0 CA--C 1.539 0.521 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.615 179.885 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.835 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 83.6 Cg_exo -49.8 162.88 0.59 Allowed 'Trans proline' 0 C--N 1.362 1.245 0 C-N-CA 122.939 2.426 . . . . 0.0 113.471 -179.562 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.468 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 41.5 p-90 -70.05 -32.78 71.05 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 177.413 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.618 ' CH2' ' HG2' ' A' ' 5' ' ' PRO . 10.8 p-90 -83.77 -16.71 43.72 Favored 'General case' 0 CA--C 1.497 -1.095 0 CA-C-N 114.917 -1.038 . . . . 0.0 111.369 178.842 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.654 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 33.6 t-105 -60.74 -44.54 95.45 Favored Pre-proline 0 N--CA 1.423 -1.798 0 C-N-CA 119.261 -0.976 . . . . 0.0 112.463 -177.114 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.55 ' HD3' ' O ' ' A' ' 5' ' ' PRO . 80.4 Cg_exo -43.03 -44.83 9.46 Favored 'Trans proline' 0 N--CA 1.46 -0.457 0 C-N-CA 122.268 1.979 . . . . 0.0 112.767 -178.565 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -60.94 -35.57 77.07 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.499 0.666 . . . . 0.0 109.501 179.361 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.654 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 9.8 mt -61.87 -53.04 61.3 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 114.858 -1.065 . . . . 0.0 112.235 -179.211 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 47.5 ttm-85 -117.29 -49.46 2.58 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 112.323 0.49 . . . . 0.0 112.323 -178.353 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.453 ' HD2' ' C ' ' A' ' 13' ' ' ARG . 4.5 tmm_? -62.56 -5.8 2.92 Favored 'General case' 0 C--O 1.249 1.052 0 CA-C-O 118.04 -0.981 . . . . 0.0 110.916 -179.29 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.309 1 O-C-N 86.157 -22.839 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 7.2 p . . . . . 0 N--CA 1.485 1.318 0 CA-C-O 120.882 0.373 . . . . 0.0 111.145 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.52 ' HB3' ' CE2' ' A' ' 4' ' ' TYR . 51.4 ttt-85 -71.1 153.32 42.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.672 -179.95 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 21.2 tpp180 -88.33 47.86 1.56 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.235 -179.618 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.832 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -68.28 -166.95 0.04 OUTLIER Pre-proline 0 CA--C 1.542 0.67 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.298 179.873 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.832 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 85.4 Cg_exo -48.8 161.52 0.48 Allowed 'Trans proline' 0 C--N 1.367 1.533 0 C-N-CA 122.723 2.282 . . . . 0.0 113.431 -179.931 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.466 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 38.4 p-90 -68.22 -33.52 74.56 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 177.457 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.579 ' CH2' ' HG2' ' A' ' 5' ' ' PRO . 9.2 p-90 -82.32 -17.38 45.95 Favored 'General case' 0 CA--C 1.497 -1.092 0 CA-C-N 114.94 -1.027 . . . . 0.0 111.119 178.724 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.651 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 33.4 t-105 -58.66 -46.26 99.59 Favored Pre-proline 0 N--CA 1.427 -1.577 0 C-N-CA 119.405 -0.918 . . . . 0.0 112.408 -177.236 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.502 ' HD3' ' O ' ' A' ' 5' ' ' PRO . 81.5 Cg_exo -41.16 -46.85 5.34 Favored 'Trans proline' 0 N--CA 1.459 -0.521 0 C-N-CA 122.439 2.093 . . . . 0.0 112.661 -178.921 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.407 ' HD1' ' O ' ' A' ' 7' ' ' TRP . 7.1 m-85 -58.9 -37.15 75.97 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 179.311 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.651 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 5.9 mt -65.3 -70.28 0.24 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.749 -179.572 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 29.7 tpt180 -87.11 -56.23 3.47 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.921 -0.582 . . . . 0.0 112.184 -178.466 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.413 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 30.1 tpt180 -64.89 3.81 0.51 Allowed 'General case' 0 C--O 1.249 1.05 0 CA-C-O 118.005 -0.998 . . . . 0.0 111.168 -179.547 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.324 1 O-C-N 88.925 -21.109 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . 0.41 HG21 ' N ' ' A' ' 2' ' ' ARG . 23.0 m . . . . . 0 N--CA 1.485 1.29 0 CA-C-O 120.647 0.26 . . . . 0.0 111.307 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.41 ' N ' HG21 ' A' ' 1' ' ' VAL . 14.5 ptp180 -175.52 51.71 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.956 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.43 ' HG2' HH11 ' A' ' 3' ' ' ARG . 14.9 tpp85 -50.78 -42.18 57.68 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.902 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.862 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -63.07 -169.62 0.04 OUTLIER Pre-proline 0 CA--C 1.541 0.607 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.773 179.946 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.862 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 80.8 Cg_exo -50.21 164.45 0.47 Allowed 'Trans proline' 0 C--N 1.362 1.275 0 C-N-CA 123.041 2.494 . . . . 0.0 113.58 -179.56 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.469 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 34.1 p-90 -71.14 -33.49 70.12 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 177.392 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.628 ' CH2' ' HG2' ' A' ' 5' ' ' PRO . 10.6 p-90 -83.28 -17.22 43.36 Favored 'General case' 0 CA--C 1.496 -1.112 0 CA-C-N 114.937 -1.029 . . . . 0.0 111.374 178.866 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.663 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 29.8 t-105 -60.9 -44.31 94.35 Favored Pre-proline 0 N--CA 1.424 -1.748 0 C-N-CA 119.162 -1.015 . . . . 0.0 112.471 -176.993 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.849 ' HA ' ' HB3' ' A' ' 13' ' ' ARG . 81.3 Cg_exo -42.95 -47.53 8.21 Favored 'Trans proline' 0 N--CA 1.459 -0.516 0 C-N-CA 122.108 1.872 . . . . 0.0 112.687 -178.488 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -57.62 -36.52 71.91 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.444 0.64 . . . . 0.0 109.303 179.201 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.663 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 9.3 mt -61.35 -39.11 89.38 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 114.892 -1.049 . . . . 0.0 111.603 -179.805 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 36.5 ttm180 -150.61 -50.86 0.13 Allowed 'General case' 0 CA--C 1.529 0.164 0 N-CA-C 112.103 0.408 . . . . 0.0 112.103 -178.79 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.849 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 5.9 tpm_? -72.09 44.74 0.11 Allowed 'General case' 0 C--O 1.249 1.034 0 CA-C-O 118.108 -0.949 . . . . 0.0 111.276 -179.555 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.34 1 O-C-N 85.565 -23.21 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.903 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.541 0.624 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.903 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 99.6 Cg_exo -48.78 163.13 0.31 Allowed 'Trans proline' 0 C--N 1.363 1.342 0 C-N-CA 122.942 2.428 . . . . 0.0 113.557 -179.579 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.45 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 35.9 p-90 -70.09 -33.53 72.0 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 177.541 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.633 ' CH2' ' HG2' ' A' ' 5' ' ' PRO . 11.6 p-90 -83.76 -16.88 43.11 Favored 'General case' 0 CA--C 1.498 -1.054 0 CA-C-N 114.845 -1.07 . . . . 0.0 111.566 178.923 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.663 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 29.0 t-105 -61.05 -44.84 95.7 Favored Pre-proline 0 N--CA 1.426 -1.663 0 C-N-CA 119.271 -0.972 . . . . 0.0 112.548 -176.966 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.783 ' HA ' ' HB3' ' A' ' 13' ' ' ARG . 81.8 Cg_exo -43.36 -47.48 9.01 Favored 'Trans proline' 0 N--CA 1.46 -0.493 0 C-N-CA 122.129 1.886 . . . . 0.0 112.87 -178.404 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -58.04 -35.23 71.0 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.463 0.649 . . . . 0.0 109.329 179.247 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.663 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 9.6 mt -62.25 -41.31 98.33 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 114.889 -1.051 . . . . 0.0 111.766 -179.613 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 53.4 ttt-85 -146.2 -47.79 0.2 Allowed 'General case' 0 CA--C 1.529 0.145 0 N-CA-C 112.257 0.466 . . . . 0.0 112.257 -178.523 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.783 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 3.3 tmt_? . . . . . 0 C--O 1.249 1.028 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.891 -179.4 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.926 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.542 0.672 0 N-CA-C 111.903 0.335 . . . . 0.0 111.903 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.926 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 92.0 Cg_exo -48.53 156.8 1.65 Allowed 'Trans proline' 0 C--N 1.364 1.376 0 C-N-CA 122.736 2.291 . . . . 0.0 113.511 -179.616 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 35.3 p-90 -64.35 -32.0 73.44 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 177.669 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.657 ' CE3' HD11 ' A' ' 11' ' ' LEU . 11.4 p-90 -84.99 -17.62 37.03 Favored 'General case' 0 CA--C 1.499 -0.989 0 CA-C-N 115.13 -0.941 . . . . 0.0 111.591 179.074 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.665 ' N ' ' HD2' ' A' ' 9' ' ' PRO . 26.4 t-105 -60.18 -44.15 95.61 Favored Pre-proline 0 N--CA 1.428 -1.559 0 C-N-CA 119.291 -0.964 . . . . 0.0 113.293 -176.576 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.84 ' HA ' ' HB3' ' A' ' 13' ' ' ARG . 2.1 Cg_endo -46.68 -44.55 21.5 Favored 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.05 1.834 . . . . 0.0 112.758 -178.231 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -59.78 -33.94 72.35 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 179.135 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.657 HD11 ' CE3' ' A' ' 7' ' ' TRP . 11.9 mt -62.28 -44.19 97.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 114.952 -1.022 . . . . 0.0 112.138 -179.498 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 79.5 ttt180 -139.57 -46.21 0.45 Allowed 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 112.222 0.452 . . . . 0.0 112.222 -178.438 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.84 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 11.7 tpt180 . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.098 -0.953 . . . . 0.0 111.389 -179.722 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.889 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.542 0.641 0 N-CA-C 111.528 0.195 . . . . 0.0 111.528 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.889 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 83.1 Cg_exo -49.34 161.66 0.65 Allowed 'Trans proline' 0 C--N 1.363 1.331 0 C-N-CA 122.793 2.329 . . . . 0.0 113.371 -179.804 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.498 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 40.1 p-90 -68.64 -33.69 74.45 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 108.069 -1.085 . . . . 0.0 108.069 177.425 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.67 ' CE3' HD11 ' A' ' 11' ' ' LEU . 11.4 p-90 -82.55 -15.48 52.16 Favored 'General case' 0 CA--C 1.495 -1.144 0 CA-C-N 114.883 -1.053 . . . . 0.0 111.311 178.749 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.653 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 29.5 t-105 -61.56 -45.46 93.78 Favored Pre-proline 0 N--CA 1.425 -1.707 0 C-N-CA 119.355 -0.938 . . . . 0.0 112.741 -176.973 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.578 ' HD3' ' O ' ' A' ' 5' ' ' PRO . 82.3 Cg_exo -43.8 -44.14 11.68 Favored 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.234 1.956 . . . . 0.0 112.905 -178.511 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -61.64 -34.83 76.38 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.384 0.611 . . . . 0.0 109.595 179.418 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.67 HD11 ' CE3' ' A' ' 7' ' ' TRP . 12.5 mt -59.47 -46.62 88.26 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 114.958 -1.019 . . . . 0.0 112.196 -179.297 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.402 ' HG2' HH11 ' A' ' 12' ' ' ARG . 43.3 mtp85 -129.69 -47.49 1.15 Allowed 'General case' 0 C--N 1.332 -0.155 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -178.698 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.416 ' HB2' ' HA ' ' A' ' 9' ' ' PRO . 40.0 mmm-85 . . . . . 0 C--O 1.25 1.107 0 CA-C-O 118.116 -0.945 . . . . 0.0 110.741 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.943 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.54 0.587 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.943 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 97.0 Cg_exo -48.7 166.94 0.13 Allowed 'Trans proline' 0 C--N 1.365 1.431 0 C-N-CA 123.08 2.52 . . . . 0.0 113.635 -179.429 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.451 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 33.9 p-90 -72.75 -34.27 66.91 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 177.43 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.666 ' CH2' ' HG2' ' A' ' 5' ' ' PRO . 10.9 p-90 -83.19 -17.33 43.23 Favored 'General case' 0 CA--C 1.498 -1.041 0 CA-C-N 114.813 -1.085 . . . . 0.0 111.604 178.987 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.66 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 26.8 t-105 -61.57 -45.25 93.7 Favored Pre-proline 0 N--CA 1.425 -1.71 0 C-N-CA 119.279 -0.969 . . . . 0.0 112.612 -176.938 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.593 ' HA ' ' HB3' ' A' ' 13' ' ' ARG . 99.8 Cg_exo -42.73 -43.34 8.83 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.444 2.096 . . . . 0.0 113.098 -178.333 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 4.7 m-85 -63.48 -35.42 80.38 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.478 0.656 . . . . 0.0 109.603 179.404 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.66 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 10.7 mt -60.33 -50.91 71.76 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.839 -1.073 . . . . 0.0 112.387 -179.198 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 44.2 ttt85 -125.27 -46.71 1.77 Allowed 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -178.239 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.593 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 12.0 tpt180 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.005 -0.998 . . . . 0.0 111.276 -179.438 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.922 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.541 0.619 0 CA-C-O 119.617 -0.23 . . . . 0.0 111.129 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.922 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 93.4 Cg_exo -47.96 157.77 1.01 Allowed 'Trans proline' 0 C--N 1.366 1.488 0 C-N-CA 122.438 2.092 . . . . 0.0 113.057 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.493 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 42.0 p-90 -64.93 -33.14 75.33 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 177.62 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.671 ' CE3' HD11 ' A' ' 11' ' ' LEU . 11.9 p-90 -83.19 -14.56 53.13 Favored 'General case' 0 CA--C 1.497 -1.058 0 CA-C-N 115.009 -0.996 . . . . 0.0 111.439 178.734 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.634 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 32.6 t-105 -61.35 -45.81 94.88 Favored Pre-proline 0 N--CA 1.427 -1.597 0 C-N-CA 119.195 -1.002 . . . . 0.0 112.352 -177.273 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.581 ' HD3' ' O ' ' A' ' 5' ' ' PRO . 85.1 Cg_exo -43.97 -44.13 12.17 Favored 'Trans proline' 0 C--N 1.348 0.508 0 C-N-CA 122.111 1.874 . . . . 0.0 112.314 -178.98 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -59.75 -36.95 77.68 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 179.137 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.671 HD11 ' CE3' ' A' ' 7' ' ' TRP . 9.3 mt -63.15 -68.15 0.36 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 114.983 -1.008 . . . . 0.0 111.637 -179.704 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.583 ' HG3' ' HE1' ' A' ' 8' ' ' TRP . 13.4 mmp_? -92.4 -55.59 3.35 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -178.799 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.459 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 32.4 tpt85 . . . . . 0 C--O 1.249 1.052 0 CA-C-O 117.966 -1.016 . . . . 0.0 111.32 -179.258 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.865 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.54 0.586 0 N-CA-C 111.638 0.236 . . . . 0.0 111.638 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.865 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 79.9 Cg_exo -49.59 160.46 1.07 Allowed 'Trans proline' 0 C--N 1.364 1.351 0 C-N-CA 122.773 2.315 . . . . 0.0 113.333 -179.751 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.508 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 32.4 p-90 -67.82 -33.11 74.15 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 177.401 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.662 ' CE3' HD11 ' A' ' 11' ' ' LEU . 10.9 p-90 -83.01 -15.91 49.24 Favored 'General case' 0 CA--C 1.496 -1.117 0 CA-C-N 114.985 -1.007 . . . . 0.0 111.233 178.748 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.632 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 29.4 t-105 -61.2 -44.8 94.79 Favored Pre-proline 0 N--CA 1.426 -1.666 0 C-N-CA 119.408 -0.917 . . . . 0.0 112.649 -177.088 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.599 ' HD3' ' O ' ' A' ' 5' ' ' PRO . 88.5 Cg_exo -42.91 -45.68 8.95 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.316 2.011 . . . . 0.0 112.758 -178.653 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 7.4 m-85 -59.23 -36.31 75.21 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.399 0.618 . . . . 0.0 109.392 179.285 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.662 HD11 ' CE3' ' A' ' 7' ' ' TRP . 7.5 mt -64.01 -70.17 0.24 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.959 -1.018 . . . . 0.0 111.665 -179.668 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 54.4 ttt-85 -86.92 -56.32 3.44 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 115.94 -0.573 . . . . 0.0 112.067 -178.709 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.418 HH11 ' HG3' ' A' ' 13' ' ' ARG . 43.7 mmm-85 . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.089 -0.958 . . . . 0.0 111.282 -179.465 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.937 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.542 0.64 0 CA-C-O 119.861 -0.114 . . . . 0.0 111.131 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.937 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 88.3 Cg_exo -48.99 154.41 3.29 Favored 'Trans proline' 0 C--N 1.363 1.302 0 C-N-CA 122.579 2.186 . . . . 0.0 113.209 -179.786 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 42.6 p-90 -61.83 -32.58 72.91 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 177.833 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.669 ' CE3' HD11 ' A' ' 11' ' ' LEU . 11.9 p-90 -84.57 -17.32 39.18 Favored 'General case' 0 CA--C 1.499 -0.991 0 CA-C-N 115.05 -0.977 . . . . 0.0 111.814 179.074 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.673 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 25.8 t-105 -60.3 -44.96 97.45 Favored Pre-proline 0 N--CA 1.428 -1.552 0 C-N-CA 119.254 -0.978 . . . . 0.0 113.548 -176.461 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.66 ' HD2' ' N ' ' A' ' 8' ' ' TRP . 1.2 Cg_endo -45.67 -44.28 17.78 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.175 1.916 . . . . 0.0 112.802 -178.099 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -60.94 -33.74 73.64 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.371 0.605 . . . . 0.0 109.463 179.279 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.673 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 12.9 mt -60.85 -49.17 78.57 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 114.955 -1.02 . . . . 0.0 112.262 -179.198 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 79.3 ttt180 -130.11 -46.26 1.12 Allowed 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -178.336 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.532 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 28.5 tpt180 . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.335 -0.841 . . . . 0.0 111.526 -179.171 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.875 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.539 0.531 0 N-CA-C 111.585 0.217 . . . . 0.0 111.585 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.875 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 80.9 Cg_exo -49.98 164.36 0.43 Allowed 'Trans proline' 0 C--N 1.362 1.239 0 C-N-CA 123.065 2.51 . . . . 0.0 113.708 -179.421 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.494 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 34.5 p-90 -71.03 -33.51 70.38 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 177.348 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.649 ' CH2' ' HG2' ' A' ' 5' ' ' PRO . 10.7 p-90 -83.18 -15.93 48.61 Favored 'General case' 0 CA--C 1.497 -1.081 0 CA-C-N 114.836 -1.074 . . . . 0.0 111.2 178.622 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.662 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 29.1 t-105 -61.61 -44.81 92.86 Favored Pre-proline 0 N--CA 1.426 -1.657 0 C-N-CA 119.281 -0.968 . . . . 0.0 112.42 -177.159 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.577 ' HD3' ' O ' ' A' ' 5' ' ' PRO . 80.7 Cg_exo -43.17 -44.66 9.83 Favored 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 122.308 2.005 . . . . 0.0 112.459 -178.606 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -59.93 -37.74 80.35 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 179.134 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.662 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 6.9 mt -63.34 -68.58 0.33 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 114.951 -1.022 . . . . 0.0 111.513 -179.79 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 12.1 tpt180 -86.12 -59.0 2.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.79 -0.641 . . . . 0.0 112.028 -178.735 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 37.0 mmt180 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.083 -0.96 . . . . 0.0 111.424 -179.209 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.938 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.54 0.576 0 N-CA-C 111.339 0.125 . . . . 0.0 111.339 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.938 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 97.9 Cg_exo -48.23 156.1 1.73 Allowed 'Trans proline' 0 C--N 1.364 1.349 0 C-N-CA 122.669 2.246 . . . . 0.0 113.328 -179.649 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 38.6 p-90 -63.55 -31.59 72.8 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 177.76 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.644 ' CE3' HD11 ' A' ' 11' ' ' LEU . 11.5 p-90 -85.61 -18.0 34.57 Favored 'General case' 0 CA--C 1.499 -0.989 0 CA-C-N 115.088 -0.96 . . . . 0.0 111.75 179.086 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.656 ' N ' ' HD2' ' A' ' 9' ' ' PRO . 25.6 t-105 -59.8 -44.27 96.79 Favored Pre-proline 0 N--CA 1.428 -1.532 0 C-N-CA 119.349 -0.94 . . . . 0.0 113.156 -176.598 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.656 ' HD2' ' N ' ' A' ' 8' ' ' TRP . 1.8 Cg_endo -46.96 -43.91 23.65 Favored 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 121.934 1.756 . . . . 0.0 112.34 -178.41 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -58.7 -35.1 72.1 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 178.887 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.644 HD11 ' CE3' ' A' ' 7' ' ' TRP . 9.1 mt -65.45 -70.07 0.26 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 114.793 -1.094 . . . . 0.0 111.551 -179.694 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 78.3 ttt180 -86.75 -56.2 3.51 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.953 -0.567 . . . . 0.0 112.006 -179.074 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 37.5 mmt180 . . . . . 0 C--O 1.25 1.093 0 CA-C-O 118.076 -0.964 . . . . 0.0 111.499 -179.182 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.936 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.541 0.626 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.936 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 88.7 Cg_exo -50.74 159.66 2.19 Favored 'Trans proline' 0 C--N 1.361 1.211 0 C-N-CA 123.095 2.53 . . . . 0.0 113.721 -179.466 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 45.8 p-90 -66.93 -31.4 71.96 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 177.619 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.642 ' CE3' HD11 ' A' ' 11' ' ' LEU . 10.6 p-90 -85.67 -17.37 36.24 Favored 'General case' 0 CA--C 1.496 -1.1 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.468 179.059 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.681 ' N ' ' HD2' ' A' ' 9' ' ' PRO . 25.2 t-105 -60.2 -43.9 94.89 Favored Pre-proline 0 N--CA 1.424 -1.735 0 C-N-CA 119.11 -1.036 . . . . 0.0 113.048 -176.871 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.681 ' HD2' ' N ' ' A' ' 8' ' ' TRP . 1.8 Cg_endo -46.09 -43.13 20.83 Favored 'Trans proline' 0 N--CA 1.459 -0.51 0 C-N-CA 122.169 1.913 . . . . 0.0 112.625 -178.355 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 -61.66 -33.72 74.46 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.424 0.63 . . . . 0.0 109.31 179.162 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.681 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 12.8 mt -61.56 -48.19 82.11 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 114.929 -1.032 . . . . 0.0 112.188 -179.383 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 56.6 ttp85 -127.88 -48.17 1.37 Allowed 'General case' 0 C--O 1.231 0.126 0 N-CA-C 111.976 0.362 . . . . 0.0 111.976 -178.829 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.589 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 29.7 tpt180 . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.081 -0.962 . . . . 0.0 111.377 -179.686 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.883 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.541 0.622 0 CA-C-O 119.65 -0.214 . . . . 0.0 111.083 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.883 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 96.4 Cg_exo -48.03 158.15 0.95 Allowed 'Trans proline' 0 C--N 1.367 1.51 0 C-N-CA 122.527 2.151 . . . . 0.0 113.092 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.474 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 39.3 p-90 -65.07 -33.38 75.9 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 177.641 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.668 ' CE3' HD11 ' A' ' 11' ' ' LEU . 12.1 p-90 -83.44 -15.82 48.15 Favored 'General case' 0 CA--C 1.497 -1.067 0 CA-C-N 115.117 -0.947 . . . . 0.0 111.541 178.93 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.623 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 32.9 t-105 -60.63 -44.74 96.28 Favored Pre-proline 0 N--CA 1.426 -1.656 0 C-N-CA 119.284 -0.967 . . . . 0.0 112.446 -177.105 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.835 ' HA ' ' HB3' ' A' ' 13' ' ' ARG . 84.3 Cg_exo -43.66 -47.53 9.51 Favored 'Trans proline' 0 N--CA 1.458 -0.562 0 C-N-CA 122.103 1.869 . . . . 0.0 112.621 -178.859 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -56.77 -35.48 68.73 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.443 0.639 . . . . 0.0 109.517 179.262 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.668 HD11 ' CE3' ' A' ' 7' ' ' TRP . 10.1 mt -62.21 -43.83 97.95 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 114.882 -1.054 . . . . 0.0 111.874 -179.312 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 74.5 mtp180 -141.77 -48.91 0.38 Allowed 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -178.825 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.835 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.034 -0.984 . . . . 0.0 110.637 -179.694 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.911 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.542 0.655 0 N-CA-C 111.391 0.145 . . . . 0.0 111.391 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.911 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 81.0 Cg_exo -48.9 158.14 1.36 Allowed 'Trans proline' 0 C--N 1.365 1.399 0 C-N-CA 122.635 2.223 . . . . 0.0 113.342 -179.794 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.449 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 39.4 p-90 -65.48 -33.68 76.5 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 177.564 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.69 ' CE3' HD11 ' A' ' 11' ' ' LEU . 9.9 p-90 -81.93 -17.69 46.23 Favored 'General case' 0 CA--C 1.497 -1.09 0 CA-C-N 115.078 -0.964 . . . . 0.0 111.178 178.557 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.651 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 35.4 t-105 -57.41 -46.49 99.8 Favored Pre-proline 0 N--CA 1.428 -1.546 0 C-N-CA 119.518 -0.873 . . . . 0.0 112.781 -176.948 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.897 ' HA ' ' HB3' ' A' ' 13' ' ' ARG . 89.2 Cg_exo -41.31 -49.63 4.79 Favored 'Trans proline' 0 N--CA 1.458 -0.58 0 C-N-CA 122.266 1.977 . . . . 0.0 112.979 -178.546 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -57.68 -35.75 71.0 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.344 0.592 . . . . 0.0 109.695 179.662 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.69 HD11 ' CE3' ' A' ' 7' ' ' TRP . 10.1 mt -59.68 -41.53 90.87 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.829 -179.538 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 72.4 mtt-85 -146.16 -48.12 0.2 Allowed 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 112.381 0.512 . . . . 0.0 112.381 -178.982 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.897 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 30.7 tpt180 . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.039 -0.981 . . . . 0.0 110.927 -179.623 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.926 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.541 0.598 0 CA-C-O 119.803 -0.141 . . . . 0.0 111.313 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.926 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 90.9 Cg_exo -48.78 162.77 0.34 Allowed 'Trans proline' 0 C--N 1.365 1.396 0 C-N-CA 122.731 2.287 . . . . 0.0 113.429 -179.74 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.484 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 33.3 p-90 -69.31 -33.44 73.16 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 177.542 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.638 ' CH2' ' HG2' ' A' ' 5' ' ' PRO . 11.3 p-90 -83.65 -16.0 46.75 Favored 'General case' 0 CA--C 1.498 -1.04 0 CA-C-N 114.945 -1.025 . . . . 0.0 111.359 178.777 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.652 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 29.1 t-105 -61.32 -44.18 92.17 Favored Pre-proline 0 N--CA 1.426 -1.645 0 C-N-CA 119.336 -0.945 . . . . 0.0 112.611 -177.016 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.599 ' HD3' ' O ' ' A' ' 5' ' ' PRO . 86.2 Cg_exo -43.46 -49.4 7.66 Favored 'Trans proline' 0 N--CA 1.46 -0.491 0 C-N-CA 122.174 1.916 . . . . 0.0 112.541 -178.649 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 7.4 m-85 -56.16 -35.35 67.09 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 179.208 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.652 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 6.8 mt -65.93 -70.58 0.23 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.09 -0.959 . . . . 0.0 111.51 -179.795 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.591 ' HA ' ' HE ' ' A' ' 12' ' ' ARG . 5.3 tpm_? -83.08 -57.51 3.25 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.987 -178.809 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 29.0 tpt180 . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.297 -0.859 . . . . 0.0 111.029 -179.386 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.925 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.541 0.612 0 CA-C-O 119.637 -0.22 . . . . 0.0 110.884 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.925 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 94.0 Cg_exo -48.01 155.8 1.66 Allowed 'Trans proline' 0 C--N 1.367 1.527 0 C-N-CA 122.377 2.051 . . . . 0.0 113.067 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.438 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 31.0 p-90 -63.46 -33.8 76.37 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 177.53 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.708 ' CE3' HD11 ' A' ' 11' ' ' LEU . 9.7 p-90 -81.39 -16.78 51.15 Favored 'General case' 0 CA--C 1.499 -0.981 0 CA-C-N 114.986 -1.006 . . . . 0.0 111.278 178.618 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.641 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 37.6 t-105 -59.18 -47.25 98.75 Favored Pre-proline 0 N--CA 1.431 -1.378 0 C-N-CA 119.358 -0.937 . . . . 0.0 112.911 -176.822 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.499 ' HD3' ' O ' ' A' ' 5' ' ' PRO . 83.4 Cg_exo -41.33 -44.29 5.71 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.445 2.097 . . . . 0.0 112.704 -178.54 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -61.49 -37.39 83.48 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 179.38 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.708 HD11 ' CE3' ' A' ' 7' ' ' TRP . 8.0 mt -63.54 -68.55 0.34 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 114.976 -1.011 . . . . 0.0 112.052 -179.415 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.553 ' HA ' ' HE ' ' A' ' 12' ' ' ARG . 5.4 tpm_? -91.13 -55.55 3.49 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.028 -0.533 . . . . 0.0 112.362 -178.163 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 36.5 mmt180 . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.063 -0.97 . . . . 0.0 111.483 -179.213 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.936 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.541 0.631 0 N-CA-C 112.016 0.376 . . . . 0.0 112.016 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.936 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 87.9 Cg_exo -50.56 163.12 0.75 Allowed 'Trans proline' 0 C--N 1.364 1.383 0 C-N-CA 123.13 2.553 . . . . 0.0 113.83 -179.478 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.452 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 33.0 p-90 -69.89 -34.49 73.62 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 177.33 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.64 ' CE3' HD11 ' A' ' 11' ' ' LEU . 10.1 p-90 -81.59 -17.51 48.02 Favored 'General case' 0 CA--C 1.496 -1.117 0 CA-C-N 114.976 -1.011 . . . . 0.0 111.11 178.591 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.621 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 42.8 t-105 -58.44 -46.25 99.63 Favored Pre-proline 0 N--CA 1.425 -1.712 0 C-N-CA 119.215 -0.994 . . . . 0.0 112.552 -177.113 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.826 ' HA ' ' HB3' ' A' ' 13' ' ' ARG . 74.3 Cg_exo -40.54 -50.81 3.69 Favored 'Trans proline' 0 N--CA 1.456 -0.684 0 C-N-CA 122.317 2.012 . . . . 0.0 112.766 -178.467 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -55.09 -37.11 66.38 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.38 0.609 . . . . 0.0 109.373 179.445 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.64 HD11 ' CE3' ' A' ' 7' ' ' TRP . 7.1 mt -62.88 -40.54 97.84 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.067 -0.97 . . . . 0.0 111.225 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 43.3 ttt85 -150.48 -51.59 0.14 Allowed 'General case' 0 CA--C 1.53 0.173 0 N-CA-C 112.002 0.371 . . . . 0.0 112.002 -179.016 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.826 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 12.1 tpt180 . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.06 -0.972 . . . . 0.0 111.179 -179.723 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.895 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.542 0.664 0 CA-C-O 119.685 -0.198 . . . . 0.0 111.004 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.895 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 82.4 Cg_exo -49.11 157.23 1.89 Allowed 'Trans proline' 0 C--N 1.366 1.489 0 C-N-CA 122.544 2.162 . . . . 0.0 113.316 -179.801 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.449 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 35.2 p-90 -64.44 -33.97 77.1 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 177.54 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.689 ' CE3' HD11 ' A' ' 11' ' ' LEU . 9.8 p-90 -81.68 -16.21 52.02 Favored 'General case' 0 CA--C 1.499 -1.011 0 CA-C-N 115.05 -0.977 . . . . 0.0 111.146 178.565 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.637 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 33.9 t-105 -59.4 -47.03 98.87 Favored Pre-proline 0 N--CA 1.429 -1.509 0 C-N-CA 119.377 -0.929 . . . . 0.0 113.06 -176.889 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.572 ' HA ' ' HB3' ' A' ' 13' ' ' ARG . 72.3 Cg_exo -41.86 -46.02 6.75 Favored 'Trans proline' 0 N--CA 1.458 -0.572 0 C-N-CA 122.224 1.949 . . . . 0.0 112.693 -178.463 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -59.4 -37.15 77.27 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.344 0.593 . . . . 0.0 109.788 179.616 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.689 HD11 ' CE3' ' A' ' 7' ' ' TRP . 10.9 mt -58.76 -42.88 89.94 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.065 -0.97 . . . . 0.0 112.253 -179.095 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.451 ' HG2' HH11 ' A' ' 12' ' ' ARG . 65.5 mtt-85 -136.51 -49.3 0.65 Allowed 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 112.474 0.546 . . . . 0.0 112.474 -178.665 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.572 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 29.6 tpt180 . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.333 -0.841 . . . . 0.0 110.933 -179.688 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.936 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.54 0.591 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.936 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 87.7 Cg_exo -49.23 159.37 1.15 Allowed 'Trans proline' 0 C--N 1.363 1.325 0 C-N-CA 123.194 2.596 . . . . 0.0 113.863 -179.212 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 34.2 p-90 -66.31 -32.35 73.7 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 177.531 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.672 ' CE3' HD11 ' A' ' 11' ' ' LEU . 11.0 p-90 -85.03 -17.3 37.94 Favored 'General case' 0 CA--C 1.499 -1.009 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.322 178.881 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.658 ' N ' ' HD2' ' A' ' 9' ' ' PRO . 25.4 t-105 -60.13 -44.82 97.4 Favored Pre-proline 0 N--CA 1.427 -1.591 0 C-N-CA 119.364 -0.934 . . . . 0.0 113.135 -176.713 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.658 ' HD2' ' N ' ' A' ' 8' ' ' TRP . 1.2 Cg_endo -45.71 -43.02 19.15 Favored 'Trans proline' 0 C--N 1.349 0.565 0 C-N-CA 121.981 1.788 . . . . 0.0 112.483 -178.453 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.4 ' H ' ' HD1' ' A' ' 10' ' ' TYR . 6.4 m-85 -57.64 -36.4 71.8 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 178.801 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.672 HD11 ' CE3' ' A' ' 7' ' ' TRP . 5.4 mt -67.08 -66.19 0.59 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 114.702 -1.136 . . . . 0.0 111.469 -179.707 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 30.4 tpt180 -87.91 -57.26 3.0 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 115.936 -0.574 . . . . 0.0 112.238 -178.727 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 27.8 mmm180 . . . . . 0 C--O 1.25 1.086 0 CA-C-O 118.094 -0.955 . . . . 0.0 111.218 -179.339 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.888 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.539 0.521 0 N-CA-C 111.615 0.228 . . . . 0.0 111.615 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.888 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 83.6 Cg_exo -49.8 162.88 0.59 Allowed 'Trans proline' 0 C--N 1.362 1.245 0 C-N-CA 122.939 2.426 . . . . 0.0 113.471 -179.562 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.475 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 41.5 p-90 -70.05 -32.78 71.05 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 177.413 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.66 ' CE3' HD11 ' A' ' 11' ' ' LEU . 10.8 p-90 -83.77 -16.71 43.72 Favored 'General case' 0 CA--C 1.497 -1.095 0 CA-C-N 114.917 -1.038 . . . . 0.0 111.369 178.842 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.66 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 33.6 t-105 -60.74 -44.54 95.45 Favored Pre-proline 0 N--CA 1.423 -1.798 0 C-N-CA 119.261 -0.976 . . . . 0.0 112.463 -177.114 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.58 ' HD3' ' O ' ' A' ' 5' ' ' PRO . 80.4 Cg_exo -43.03 -44.83 9.46 Favored 'Trans proline' 0 N--CA 1.46 -0.457 0 C-N-CA 122.268 1.979 . . . . 0.0 112.767 -178.565 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -60.94 -35.57 77.07 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.499 0.666 . . . . 0.0 109.501 179.361 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.66 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 9.8 mt -61.87 -53.04 61.3 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 114.858 -1.065 . . . . 0.0 112.235 -179.211 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 47.5 ttm-85 -117.29 -49.46 2.58 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 112.323 0.49 . . . . 0.0 112.323 -178.353 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.442 ' C ' ' HD2' ' A' ' 13' ' ' ARG . 4.5 tmm_? . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.04 -0.981 . . . . 0.0 110.916 -179.29 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.899 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.542 0.67 0 N-CA-C 111.298 0.11 . . . . 0.0 111.298 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.899 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 85.4 Cg_exo -48.8 161.52 0.48 Allowed 'Trans proline' 0 C--N 1.367 1.533 0 C-N-CA 122.723 2.282 . . . . 0.0 113.431 -179.931 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.471 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 38.4 p-90 -68.22 -33.52 74.56 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 177.457 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.669 ' CE3' HD11 ' A' ' 11' ' ' LEU . 9.2 p-90 -82.32 -17.38 45.95 Favored 'General case' 0 CA--C 1.497 -1.092 0 CA-C-N 114.94 -1.027 . . . . 0.0 111.119 178.724 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.641 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 33.4 t-105 -58.66 -46.26 99.59 Favored Pre-proline 0 N--CA 1.427 -1.577 0 C-N-CA 119.405 -0.918 . . . . 0.0 112.408 -177.236 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.537 ' HD3' ' O ' ' A' ' 5' ' ' PRO . 81.5 Cg_exo -41.16 -46.85 5.34 Favored 'Trans proline' 0 N--CA 1.459 -0.521 0 C-N-CA 122.439 2.093 . . . . 0.0 112.661 -178.921 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.408 ' HD1' ' O ' ' A' ' 7' ' ' TRP . 7.1 m-85 -58.9 -37.15 75.97 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 179.311 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.669 HD11 ' CE3' ' A' ' 7' ' ' TRP . 5.9 mt -65.3 -70.28 0.24 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.749 -179.572 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 29.7 tpt180 -87.11 -56.23 3.47 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.921 -0.582 . . . . 0.0 112.184 -178.466 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.473 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 30.1 tpt180 . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.005 -0.998 . . . . 0.0 111.168 -179.547 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.927 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.541 0.607 0 N-CA-C 111.773 0.286 . . . . 0.0 111.773 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.927 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 80.8 Cg_exo -50.21 164.45 0.47 Allowed 'Trans proline' 0 C--N 1.362 1.275 0 C-N-CA 123.041 2.494 . . . . 0.0 113.58 -179.56 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.479 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 34.1 p-90 -71.14 -33.49 70.12 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 177.392 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.652 ' CH2' ' HG2' ' A' ' 5' ' ' PRO . 10.6 p-90 -83.28 -17.22 43.36 Favored 'General case' 0 CA--C 1.496 -1.112 0 CA-C-N 114.937 -1.029 . . . . 0.0 111.374 178.866 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.664 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 29.8 t-105 -60.9 -44.31 94.35 Favored Pre-proline 0 N--CA 1.424 -1.748 0 C-N-CA 119.162 -1.015 . . . . 0.0 112.471 -176.993 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.833 ' HA ' ' HB3' ' A' ' 13' ' ' ARG . 81.3 Cg_exo -42.95 -47.53 8.21 Favored 'Trans proline' 0 N--CA 1.459 -0.516 0 C-N-CA 122.108 1.872 . . . . 0.0 112.687 -178.488 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -57.62 -36.52 71.91 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.444 0.64 . . . . 0.0 109.303 179.201 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.664 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 9.3 mt -61.35 -39.11 89.38 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 114.892 -1.049 . . . . 0.0 111.603 -179.805 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 36.5 ttm180 -150.61 -50.86 0.13 Allowed 'General case' 0 CA--C 1.529 0.164 0 N-CA-C 112.103 0.408 . . . . 0.0 112.103 -178.79 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.833 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 5.9 tpm_? . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.108 -0.949 . . . . 0.0 111.276 -179.555 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 30.3 m . . . . . 0 N--CA 1.485 1.296 0 CA-C-O 120.917 0.389 . . . . 0.0 111.204 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.424 ' HB3' ' CE1' ' A' ' 4' ' ' TYR . 47.9 ttm-85 -65.07 -49.96 68.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.969 179.959 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.406 ' HG2' HH11 ' A' ' 3' ' ' ARG . 53.2 ttt-85 -174.9 -38.98 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.056 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.903 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -59.39 -169.53 0.02 OUTLIER Pre-proline 0 CA--C 1.541 0.624 0 CA-C-N 116.278 -0.419 . . . . 0.0 112.093 -179.532 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.903 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 99.6 Cg_exo -48.78 163.13 0.31 Allowed 'Trans proline' 0 C--N 1.363 1.342 0 C-N-CA 122.942 2.428 . . . . 0.0 113.557 -179.579 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.45 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 35.9 p-90 -70.09 -33.53 72.0 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 177.541 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.633 ' CH2' ' HG2' ' A' ' 5' ' ' PRO . 11.6 p-90 -83.76 -16.88 43.11 Favored 'General case' 0 CA--C 1.498 -1.054 0 CA-C-N 114.845 -1.07 . . . . 0.0 111.566 178.923 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.663 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 29.0 t-105 -61.05 -44.84 95.7 Favored Pre-proline 0 N--CA 1.426 -1.663 0 C-N-CA 119.271 -0.972 . . . . 0.0 112.548 -176.966 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.783 ' HA ' ' HB3' ' A' ' 13' ' ' ARG . 81.8 Cg_exo -43.36 -47.48 9.01 Favored 'Trans proline' 0 N--CA 1.46 -0.493 0 C-N-CA 122.129 1.886 . . . . 0.0 112.87 -178.404 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -58.04 -35.23 71.0 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.463 0.649 . . . . 0.0 109.329 179.247 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.663 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 9.6 mt -62.25 -41.31 98.33 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 114.889 -1.051 . . . . 0.0 111.766 -179.613 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 53.4 ttt-85 -146.2 -47.79 0.2 Allowed 'General case' 0 CA--C 1.529 0.145 0 N-CA-C 112.257 0.466 . . . . 0.0 112.257 -178.523 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.783 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 3.3 tmt_? -71.64 33.93 0.05 Allowed 'General case' 0 C--O 1.249 1.028 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.891 -179.4 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.273 1 O-C-N 78.809 -27.432 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 27.8 m . . . . . 0 N--CA 1.486 1.339 0 CA-C-O 120.945 0.402 . . . . 0.0 111.276 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.52 ' HB2' HH11 ' A' ' 13' ' ' ARG . 0.0 OUTLIER -62.27 -48.68 78.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.432 179.879 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 79.3 ttt180 -174.42 -41.49 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.759 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.926 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -60.75 -167.8 0.02 OUTLIER Pre-proline 0 CA--C 1.542 0.672 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.903 -179.796 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.926 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 92.0 Cg_exo -48.53 156.8 1.65 Allowed 'Trans proline' 0 C--N 1.364 1.376 0 C-N-CA 122.736 2.291 . . . . 0.0 113.511 -179.616 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 35.3 p-90 -64.35 -32.0 73.44 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 177.669 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.657 ' CE3' HD11 ' A' ' 11' ' ' LEU . 11.4 p-90 -84.99 -17.62 37.03 Favored 'General case' 0 CA--C 1.499 -0.989 0 CA-C-N 115.13 -0.941 . . . . 0.0 111.591 179.074 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.665 ' N ' ' HD2' ' A' ' 9' ' ' PRO . 26.4 t-105 -60.18 -44.15 95.61 Favored Pre-proline 0 N--CA 1.428 -1.559 0 C-N-CA 119.291 -0.964 . . . . 0.0 113.293 -176.576 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.84 ' HA ' ' HB3' ' A' ' 13' ' ' ARG . 2.1 Cg_endo -46.68 -44.55 21.5 Favored 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.05 1.834 . . . . 0.0 112.758 -178.231 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -59.78 -33.94 72.35 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 179.135 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.657 HD11 ' CE3' ' A' ' 7' ' ' TRP . 11.9 mt -62.28 -44.19 97.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 114.952 -1.022 . . . . 0.0 112.138 -179.498 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 79.5 ttt180 -139.57 -46.21 0.45 Allowed 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 112.222 0.452 . . . . 0.0 112.222 -178.438 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.84 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 11.7 tpt180 -70.85 34.7 0.05 OUTLIER 'General case' 0 C--O 1.249 1.036 0 CA-C-O 118.098 -0.953 . . . . 0.0 111.389 -179.722 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.342 1 O-C-N 85.39 -23.319 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 8.0 p . . . . . 0 N--CA 1.485 1.323 0 CA-C-O 120.799 0.333 . . . . 0.0 111.087 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -61.53 138.74 58.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.021 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.406 ' HG2' HH11 ' A' ' 3' ' ' ARG . 14.8 tpp85 -168.67 -43.29 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.152 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.889 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -63.97 -168.16 0.03 OUTLIER Pre-proline 0 CA--C 1.542 0.641 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.528 179.884 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.889 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 83.1 Cg_exo -49.34 161.66 0.65 Allowed 'Trans proline' 0 C--N 1.363 1.331 0 C-N-CA 122.793 2.329 . . . . 0.0 113.371 -179.804 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.498 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 40.1 p-90 -68.64 -33.69 74.45 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 108.069 -1.085 . . . . 0.0 108.069 177.425 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.67 ' CE3' HD11 ' A' ' 11' ' ' LEU . 11.4 p-90 -82.55 -15.48 52.16 Favored 'General case' 0 CA--C 1.495 -1.144 0 CA-C-N 114.883 -1.053 . . . . 0.0 111.311 178.749 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.653 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 29.5 t-105 -61.56 -45.46 93.78 Favored Pre-proline 0 N--CA 1.425 -1.707 0 C-N-CA 119.355 -0.938 . . . . 0.0 112.741 -176.973 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.578 ' HD3' ' O ' ' A' ' 5' ' ' PRO . 82.3 Cg_exo -43.8 -44.14 11.68 Favored 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.234 1.956 . . . . 0.0 112.905 -178.511 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -61.64 -34.83 76.38 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.384 0.611 . . . . 0.0 109.595 179.418 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.67 HD11 ' CE3' ' A' ' 7' ' ' TRP . 12.5 mt -59.47 -46.62 88.26 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 114.958 -1.019 . . . . 0.0 112.196 -179.297 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.402 ' HG2' HH11 ' A' ' 12' ' ' ARG . 43.3 mtp85 -129.69 -47.49 1.15 Allowed 'General case' 0 C--N 1.332 -0.155 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -178.698 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.416 ' HB2' ' HA ' ' A' ' 9' ' ' PRO . 40.0 mmm-85 -68.46 19.35 0.03 OUTLIER 'General case' 0 C--O 1.25 1.107 0 CA-C-O 118.116 -0.945 . . . . 0.0 110.741 -179.927 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.257 0 CA-C-N 119.176 0.898 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 27.8 m . . . . . 0 N--CA 1.485 1.295 0 CA-C-O 120.862 0.363 . . . . 0.0 111.23 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.426 ' HB2' ' CZ ' ' A' ' 4' ' ' TYR . 97.8 mtt180 -57.18 140.39 49.72 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.293 -179.658 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 82.0 mtm180 -95.6 135.51 37.17 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.609 179.675 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.943 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -162.94 -169.1 0.21 Allowed Pre-proline 0 CA--C 1.54 0.587 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 179.753 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.943 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 97.0 Cg_exo -48.7 166.94 0.13 Allowed 'Trans proline' 0 C--N 1.365 1.431 0 C-N-CA 123.08 2.52 . . . . 0.0 113.635 -179.429 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.451 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 33.9 p-90 -72.75 -34.27 66.91 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 177.43 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.666 ' CH2' ' HG2' ' A' ' 5' ' ' PRO . 10.9 p-90 -83.19 -17.33 43.23 Favored 'General case' 0 CA--C 1.498 -1.041 0 CA-C-N 114.813 -1.085 . . . . 0.0 111.604 178.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.66 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 26.8 t-105 -61.57 -45.25 93.7 Favored Pre-proline 0 N--CA 1.425 -1.71 0 C-N-CA 119.279 -0.969 . . . . 0.0 112.612 -176.938 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.593 ' HA ' ' HB3' ' A' ' 13' ' ' ARG . 99.8 Cg_exo -42.73 -43.34 8.83 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.444 2.096 . . . . 0.0 113.098 -178.333 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 4.7 m-85 -63.48 -35.42 80.38 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.478 0.656 . . . . 0.0 109.603 179.404 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.66 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 10.7 mt -60.33 -50.91 71.76 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.839 -1.073 . . . . 0.0 112.387 -179.198 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 44.2 ttt85 -125.27 -46.71 1.77 Allowed 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -178.239 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.593 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 12.0 tpt180 -63.23 4.97 0.17 Allowed 'General case' 0 C--O 1.249 1.043 0 CA-C-O 118.005 -0.998 . . . . 0.0 111.276 -179.438 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.343 1 O-C-N 87.176 -22.202 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 7.6 p . . . . . 0 N--CA 1.485 1.32 0 CA-C-O 120.616 0.246 . . . . 0.0 111.13 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 54.9 mmt-85 -60.02 -42.38 94.19 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.464 -0.335 . . . . 0.0 110.763 179.804 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 39.4 ttm180 -56.22 135.56 53.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.559 179.81 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.922 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -138.38 -163.7 0.06 OUTLIER Pre-proline 0 CA--C 1.541 0.619 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.129 -179.697 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.922 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 93.4 Cg_exo -47.96 157.77 1.01 Allowed 'Trans proline' 0 C--N 1.366 1.488 0 C-N-CA 122.438 2.092 . . . . 0.0 113.057 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.493 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 42.0 p-90 -64.93 -33.14 75.33 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 177.62 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.671 ' CE3' HD11 ' A' ' 11' ' ' LEU . 11.9 p-90 -83.19 -14.56 53.13 Favored 'General case' 0 CA--C 1.497 -1.058 0 CA-C-N 115.009 -0.996 . . . . 0.0 111.439 178.734 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.634 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 32.6 t-105 -61.35 -45.81 94.88 Favored Pre-proline 0 N--CA 1.427 -1.597 0 C-N-CA 119.195 -1.002 . . . . 0.0 112.352 -177.273 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.581 ' HD3' ' O ' ' A' ' 5' ' ' PRO . 85.1 Cg_exo -43.97 -44.13 12.17 Favored 'Trans proline' 0 C--N 1.348 0.508 0 C-N-CA 122.111 1.874 . . . . 0.0 112.314 -178.98 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -59.75 -36.95 77.68 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 179.137 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.671 HD11 ' CE3' ' A' ' 7' ' ' TRP . 9.3 mt -63.15 -68.15 0.36 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 114.983 -1.008 . . . . 0.0 111.637 -179.704 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.583 ' HG3' ' HE1' ' A' ' 8' ' ' TRP . 13.4 mmp_? -92.4 -55.59 3.35 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -178.799 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.459 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 32.4 tpt85 -62.84 3.42 0.23 Allowed 'General case' 0 C--O 1.249 1.052 0 CA-C-O 117.966 -1.016 . . . . 0.0 111.32 -179.258 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.341 1 O-C-N 96.323 -16.486 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' VAL . . . . . 0.486 ' O ' HG22 ' A' ' 1' ' ' VAL . 14.5 p . . . . . 0 N--CA 1.486 1.329 0 CA-C-O 121.415 0.626 . . . . 0.0 110.618 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 30.7 tpt180 -174.54 -53.11 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.752 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 39.4 mmt180 -93.87 37.8 1.08 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.036 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.865 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -65.13 -168.98 0.04 OUTLIER Pre-proline 0 CA--C 1.54 0.586 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.638 -179.899 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.865 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 79.9 Cg_exo -49.59 160.46 1.07 Allowed 'Trans proline' 0 C--N 1.364 1.351 0 C-N-CA 122.773 2.315 . . . . 0.0 113.333 -179.751 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.508 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 32.4 p-90 -67.82 -33.11 74.15 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 177.401 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.662 ' CE3' HD11 ' A' ' 11' ' ' LEU . 10.9 p-90 -83.01 -15.91 49.24 Favored 'General case' 0 CA--C 1.496 -1.117 0 CA-C-N 114.985 -1.007 . . . . 0.0 111.233 178.748 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.632 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 29.4 t-105 -61.2 -44.8 94.79 Favored Pre-proline 0 N--CA 1.426 -1.666 0 C-N-CA 119.408 -0.917 . . . . 0.0 112.649 -177.088 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.599 ' HD3' ' O ' ' A' ' 5' ' ' PRO . 88.5 Cg_exo -42.91 -45.68 8.95 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.316 2.011 . . . . 0.0 112.758 -178.653 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 7.4 m-85 -59.23 -36.31 75.21 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.399 0.618 . . . . 0.0 109.392 179.285 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.662 HD11 ' CE3' ' A' ' 7' ' ' TRP . 7.5 mt -64.01 -70.17 0.24 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.959 -1.018 . . . . 0.0 111.665 -179.668 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 54.4 ttt-85 -86.92 -56.32 3.44 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 115.94 -0.573 . . . . 0.0 112.067 -178.709 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.418 HH11 ' HG3' ' A' ' 13' ' ' ARG . 43.7 mmm-85 -66.83 3.45 1.05 Allowed 'General case' 0 C--O 1.249 1.078 0 CA-C-O 118.089 -0.958 . . . . 0.0 111.282 -179.465 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.333 1 O-C-N 102.107 -12.871 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 57.6 t . . . . . 0 N--CA 1.485 1.318 0 CA-C-O 120.844 0.354 . . . . 0.0 110.986 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.428 ' HG2' HH11 ' A' ' 2' ' ' ARG . 0.7 OUTLIER -76.12 148.63 37.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.935 179.748 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.417 ' HG2' HH11 ' A' ' 3' ' ' ARG . 51.6 ttt-85 -161.39 -45.92 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.181 179.888 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.937 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -64.89 -167.09 0.03 OUTLIER Pre-proline 0 CA--C 1.542 0.64 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.131 179.533 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.937 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 88.3 Cg_exo -48.99 154.41 3.29 Favored 'Trans proline' 0 C--N 1.363 1.302 0 C-N-CA 122.579 2.186 . . . . 0.0 113.209 -179.786 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 42.6 p-90 -61.83 -32.58 72.91 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 177.833 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.669 ' CE3' HD11 ' A' ' 11' ' ' LEU . 11.9 p-90 -84.57 -17.32 39.18 Favored 'General case' 0 CA--C 1.499 -0.991 0 CA-C-N 115.05 -0.977 . . . . 0.0 111.814 179.074 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.673 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 25.8 t-105 -60.3 -44.96 97.45 Favored Pre-proline 0 N--CA 1.428 -1.552 0 C-N-CA 119.254 -0.978 . . . . 0.0 113.548 -176.461 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.66 ' HD2' ' N ' ' A' ' 8' ' ' TRP . 1.2 Cg_endo -45.67 -44.28 17.78 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.175 1.916 . . . . 0.0 112.802 -178.099 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -60.94 -33.74 73.64 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.371 0.605 . . . . 0.0 109.463 179.279 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.673 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 12.9 mt -60.85 -49.17 78.57 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 114.955 -1.02 . . . . 0.0 112.262 -179.198 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 79.3 ttt180 -130.11 -46.26 1.12 Allowed 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -178.336 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.532 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 28.5 tpt180 -71.02 19.3 0.05 Allowed 'General case' 0 C--O 1.249 1.033 0 CA-C-O 118.335 -0.841 . . . . 0.0 111.526 -179.171 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.308 1 O-C-N 99.977 -14.202 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 11.6 p . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 120.799 0.333 . . . . 0.0 110.979 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 78.5 ttt180 -170.14 134.69 1.26 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.771 -179.78 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.576 ' HA ' ' NE ' ' A' ' 3' ' ' ARG . 5.6 tpm_? -168.31 43.97 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.044 0.45 . . . . 0.0 111.18 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.875 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -165.32 -170.91 0.24 Allowed Pre-proline 0 CA--C 1.539 0.531 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.585 179.133 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.875 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 80.9 Cg_exo -49.98 164.36 0.43 Allowed 'Trans proline' 0 C--N 1.362 1.239 0 C-N-CA 123.065 2.51 . . . . 0.0 113.708 -179.421 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.494 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 34.5 p-90 -71.03 -33.51 70.38 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 177.348 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.649 ' CH2' ' HG2' ' A' ' 5' ' ' PRO . 10.7 p-90 -83.18 -15.93 48.61 Favored 'General case' 0 CA--C 1.497 -1.081 0 CA-C-N 114.836 -1.074 . . . . 0.0 111.2 178.622 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.662 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 29.1 t-105 -61.61 -44.81 92.86 Favored Pre-proline 0 N--CA 1.426 -1.657 0 C-N-CA 119.281 -0.968 . . . . 0.0 112.42 -177.159 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.577 ' HD3' ' O ' ' A' ' 5' ' ' PRO . 80.7 Cg_exo -43.17 -44.66 9.83 Favored 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 122.308 2.005 . . . . 0.0 112.459 -178.606 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -59.93 -37.74 80.35 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 179.134 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.662 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 6.9 mt -63.34 -68.58 0.33 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 114.951 -1.022 . . . . 0.0 111.513 -179.79 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 12.1 tpt180 -86.12 -59.0 2.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.79 -0.641 . . . . 0.0 112.028 -178.735 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 37.0 mmt180 -71.47 51.07 0.18 Allowed 'General case' 0 C--O 1.249 1.049 0 CA-C-O 118.083 -0.96 . . . . 0.0 111.424 -179.209 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.376 1 O-C-N 110.765 -7.459 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 7.5 p . . . . . 0 N--CA 1.485 1.303 0 CA-C-O 120.8 0.333 . . . . 0.0 111.136 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.42 HH11 ' HG2' ' A' ' 2' ' ' ARG . 11.8 tpt180 -170.76 -46.72 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.872 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.425 ' HG3' ' O ' ' A' ' 3' ' ' ARG . 10.5 tpt180 -87.67 35.47 0.73 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.714 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.938 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -71.65 -168.23 0.08 OUTLIER Pre-proline 0 CA--C 1.54 0.576 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.339 179.938 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.938 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 97.9 Cg_exo -48.23 156.1 1.73 Allowed 'Trans proline' 0 C--N 1.364 1.349 0 C-N-CA 122.669 2.246 . . . . 0.0 113.328 -179.649 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 38.6 p-90 -63.55 -31.59 72.8 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 177.76 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.644 ' CE3' HD11 ' A' ' 11' ' ' LEU . 11.5 p-90 -85.61 -18.0 34.57 Favored 'General case' 0 CA--C 1.499 -0.989 0 CA-C-N 115.088 -0.96 . . . . 0.0 111.75 179.086 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.656 ' N ' ' HD2' ' A' ' 9' ' ' PRO . 25.6 t-105 -59.8 -44.27 96.79 Favored Pre-proline 0 N--CA 1.428 -1.532 0 C-N-CA 119.349 -0.94 . . . . 0.0 113.156 -176.598 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.656 ' HD2' ' N ' ' A' ' 8' ' ' TRP . 1.8 Cg_endo -46.96 -43.91 23.65 Favored 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 121.934 1.756 . . . . 0.0 112.34 -178.41 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -58.7 -35.1 72.1 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 178.887 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.644 HD11 ' CE3' ' A' ' 7' ' ' TRP . 9.1 mt -65.45 -70.07 0.26 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 114.793 -1.094 . . . . 0.0 111.551 -179.694 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 78.3 ttt180 -86.75 -56.2 3.51 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.953 -0.567 . . . . 0.0 112.006 -179.074 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 37.5 mmt180 -70.09 17.05 0.06 Allowed 'General case' 0 C--O 1.25 1.093 0 CA-C-O 118.076 -0.964 . . . . 0.0 111.499 -179.182 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.365 0 O-C-N 120.841 -1.162 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' VAL . . . . . 0.45 HG12 ' O ' ' A' ' 1' ' ' VAL . 18.1 t . . . . . 0 N--CA 1.485 1.298 0 CA-C-O 121.235 0.541 . . . . 0.0 110.741 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 78.4 ttt180 -67.33 145.99 54.55 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.965 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 78.5 ttt180 -168.21 -46.26 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.218 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.936 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -68.06 -170.03 0.08 OUTLIER Pre-proline 0 CA--C 1.541 0.626 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.874 179.902 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.936 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 88.7 Cg_exo -50.74 159.66 2.19 Favored 'Trans proline' 0 C--N 1.361 1.211 0 C-N-CA 123.095 2.53 . . . . 0.0 113.721 -179.466 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 45.8 p-90 -66.93 -31.4 71.96 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 177.619 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.642 ' CE3' HD11 ' A' ' 11' ' ' LEU . 10.6 p-90 -85.67 -17.37 36.24 Favored 'General case' 0 CA--C 1.496 -1.1 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.468 179.059 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.681 ' N ' ' HD2' ' A' ' 9' ' ' PRO . 25.2 t-105 -60.2 -43.9 94.89 Favored Pre-proline 0 N--CA 1.424 -1.735 0 C-N-CA 119.11 -1.036 . . . . 0.0 113.048 -176.871 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.681 ' HD2' ' N ' ' A' ' 8' ' ' TRP . 1.8 Cg_endo -46.09 -43.13 20.83 Favored 'Trans proline' 0 N--CA 1.459 -0.51 0 C-N-CA 122.169 1.913 . . . . 0.0 112.625 -178.355 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 -61.66 -33.72 74.46 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.424 0.63 . . . . 0.0 109.31 179.162 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.681 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 12.8 mt -61.56 -48.19 82.11 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 114.929 -1.032 . . . . 0.0 112.188 -179.383 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 56.6 ttp85 -127.88 -48.17 1.37 Allowed 'General case' 0 C--O 1.231 0.126 0 N-CA-C 111.976 0.362 . . . . 0.0 111.976 -178.829 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.589 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 29.7 tpt180 -67.43 17.89 0.03 OUTLIER 'General case' 0 C--O 1.249 1.045 0 CA-C-O 118.081 -0.962 . . . . 0.0 111.377 -179.686 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.33 1 O-C-N 95.13 -17.231 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 8.7 p . . . . . 0 N--CA 1.485 1.303 0 CA-C-O 120.837 0.351 . . . . 0.0 111.034 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 59.4 mtt85 -58.26 128.62 38.08 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.872 -179.893 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 45.5 mmm-85 -109.37 137.28 47.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.763 179.885 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.883 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -157.17 -163.81 0.08 OUTLIER Pre-proline 0 CA--C 1.541 0.622 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.083 -179.68 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.883 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 96.4 Cg_exo -48.03 158.15 0.95 Allowed 'Trans proline' 0 C--N 1.367 1.51 0 C-N-CA 122.527 2.151 . . . . 0.0 113.092 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.474 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 39.3 p-90 -65.07 -33.38 75.9 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 177.641 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.668 ' CE3' HD11 ' A' ' 11' ' ' LEU . 12.1 p-90 -83.44 -15.82 48.15 Favored 'General case' 0 CA--C 1.497 -1.067 0 CA-C-N 115.117 -0.947 . . . . 0.0 111.541 178.93 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.623 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 32.9 t-105 -60.63 -44.74 96.28 Favored Pre-proline 0 N--CA 1.426 -1.656 0 C-N-CA 119.284 -0.967 . . . . 0.0 112.446 -177.105 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.835 ' HA ' ' HB3' ' A' ' 13' ' ' ARG . 84.3 Cg_exo -43.66 -47.53 9.51 Favored 'Trans proline' 0 N--CA 1.458 -0.562 0 C-N-CA 122.103 1.869 . . . . 0.0 112.621 -178.859 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -56.77 -35.48 68.73 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.443 0.639 . . . . 0.0 109.517 179.262 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.668 HD11 ' CE3' ' A' ' 7' ' ' TRP . 10.1 mt -62.21 -43.83 97.95 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 114.882 -1.054 . . . . 0.0 111.874 -179.312 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 74.5 mtp180 -141.77 -48.91 0.38 Allowed 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -178.825 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.835 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 0.0 OUTLIER -68.66 23.55 0.03 OUTLIER 'General case' 0 C--O 1.249 1.04 0 CA-C-O 118.034 -0.984 . . . . 0.0 110.637 -179.694 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 14' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.314 1 O-C-N 90.937 -19.852 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 35.9 m . . . . . 0 N--CA 1.487 1.376 0 CA-C-O 120.756 0.312 . . . . 0.0 111.212 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.505 ' HB2' ' CE2' ' A' ' 4' ' ' TYR . 98.9 mtt180 -58.65 151.18 21.38 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.148 -179.775 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.539 ' HD2' ' N ' ' A' ' 3' ' ' ARG . 7.1 mpt_? -87.17 43.74 1.12 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.429 -179.52 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.911 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -64.34 -167.6 0.03 OUTLIER Pre-proline 0 CA--C 1.542 0.655 0 C-N-CA 120.952 -0.299 . . . . 0.0 111.391 -179.952 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.911 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 81.0 Cg_exo -48.9 158.14 1.36 Allowed 'Trans proline' 0 C--N 1.365 1.399 0 C-N-CA 122.635 2.223 . . . . 0.0 113.342 -179.794 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.449 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 39.4 p-90 -65.48 -33.68 76.5 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 177.564 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.69 ' CE3' HD11 ' A' ' 11' ' ' LEU . 9.9 p-90 -81.93 -17.69 46.23 Favored 'General case' 0 CA--C 1.497 -1.09 0 CA-C-N 115.078 -0.964 . . . . 0.0 111.178 178.557 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.651 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 35.4 t-105 -57.41 -46.49 99.8 Favored Pre-proline 0 N--CA 1.428 -1.546 0 C-N-CA 119.518 -0.873 . . . . 0.0 112.781 -176.948 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.897 ' HA ' ' HB3' ' A' ' 13' ' ' ARG . 89.2 Cg_exo -41.31 -49.63 4.79 Favored 'Trans proline' 0 N--CA 1.458 -0.58 0 C-N-CA 122.266 1.977 . . . . 0.0 112.979 -178.546 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -57.68 -35.75 71.0 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.344 0.592 . . . . 0.0 109.695 179.662 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.69 HD11 ' CE3' ' A' ' 7' ' ' TRP . 10.1 mt -59.68 -41.53 90.87 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.829 -179.538 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 72.4 mtt-85 -146.16 -48.12 0.2 Allowed 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 112.381 0.512 . . . . 0.0 112.381 -178.982 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.897 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 30.7 tpt180 -66.29 17.65 0.02 OUTLIER 'General case' 0 C--O 1.249 1.06 0 CA-C-O 118.039 -0.981 . . . . 0.0 110.927 -179.623 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.294 1 O-C-N 89.022 -21.049 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 8.6 p . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.708 0.29 . . . . 0.0 111.122 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 37.7 ptt180 -60.39 139.5 57.65 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.278 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 9.8 ptp180 -167.4 42.82 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.86 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.926 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -143.58 -166.28 0.12 Allowed Pre-proline 0 CA--C 1.541 0.598 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.313 179.843 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.926 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 90.9 Cg_exo -48.78 162.77 0.34 Allowed 'Trans proline' 0 C--N 1.365 1.396 0 C-N-CA 122.731 2.287 . . . . 0.0 113.429 -179.74 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.484 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 33.3 p-90 -69.31 -33.44 73.16 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 177.542 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.638 ' CH2' ' HG2' ' A' ' 5' ' ' PRO . 11.3 p-90 -83.65 -16.0 46.75 Favored 'General case' 0 CA--C 1.498 -1.04 0 CA-C-N 114.945 -1.025 . . . . 0.0 111.359 178.777 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.652 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 29.1 t-105 -61.32 -44.18 92.17 Favored Pre-proline 0 N--CA 1.426 -1.645 0 C-N-CA 119.336 -0.945 . . . . 0.0 112.611 -177.016 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.599 ' HD3' ' O ' ' A' ' 5' ' ' PRO . 86.2 Cg_exo -43.46 -49.4 7.66 Favored 'Trans proline' 0 N--CA 1.46 -0.491 0 C-N-CA 122.174 1.916 . . . . 0.0 112.541 -178.649 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 7.4 m-85 -56.16 -35.35 67.09 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 179.208 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.652 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 6.8 mt -65.93 -70.58 0.23 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.09 -0.959 . . . . 0.0 111.51 -179.795 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.591 ' HA ' ' HE ' ' A' ' 12' ' ' ARG . 5.3 tpm_? -83.08 -57.51 3.25 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.987 -178.809 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 29.0 tpt180 -63.22 -3.43 1.85 Allowed 'General case' 0 C--O 1.249 1.062 0 CA-C-O 118.297 -0.859 . . . . 0.0 111.029 -179.386 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.311 1 O-C-N 82.269 -25.27 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' VAL . . . . . 0.416 ' H3 ' ' NH2' ' A' ' 13' ' ' ARG . 12.2 p . . . . . 0 N--CA 1.485 1.299 0 CA-C-O 120.853 0.358 . . . . 0.0 111.099 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 57.6 ttp85 -68.7 134.1 49.36 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.45 179.629 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 9.6 ptp180 -169.1 43.25 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.924 0.392 . . . . 0.0 111.287 -179.733 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.925 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -149.44 -163.75 0.07 OUTLIER Pre-proline 0 CA--C 1.541 0.612 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.884 179.542 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.925 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 94.0 Cg_exo -48.01 155.8 1.66 Allowed 'Trans proline' 0 C--N 1.367 1.527 0 C-N-CA 122.377 2.051 . . . . 0.0 113.067 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.438 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 31.0 p-90 -63.46 -33.8 76.37 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 177.53 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.708 ' CE3' HD11 ' A' ' 11' ' ' LEU . 9.7 p-90 -81.39 -16.78 51.15 Favored 'General case' 0 CA--C 1.499 -0.981 0 CA-C-N 114.986 -1.006 . . . . 0.0 111.278 178.618 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.641 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 37.6 t-105 -59.18 -47.25 98.75 Favored Pre-proline 0 N--CA 1.431 -1.378 0 C-N-CA 119.358 -0.937 . . . . 0.0 112.911 -176.822 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.499 ' HD3' ' O ' ' A' ' 5' ' ' PRO . 83.4 Cg_exo -41.33 -44.29 5.71 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.445 2.097 . . . . 0.0 112.704 -178.54 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -61.49 -37.39 83.48 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 179.38 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.708 HD11 ' CE3' ' A' ' 7' ' ' TRP . 8.0 mt -63.54 -68.55 0.34 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 114.976 -1.011 . . . . 0.0 112.052 -179.415 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.553 ' HA ' ' HE ' ' A' ' 12' ' ' ARG . 5.4 tpm_? -91.13 -55.55 3.49 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.028 -0.533 . . . . 0.0 112.362 -178.163 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.416 ' NH2' ' H3 ' ' A' ' 1' ' ' VAL . 36.5 mmt180 -70.64 24.16 0.04 OUTLIER 'General case' 0 C--O 1.248 1.022 0 CA-C-O 118.063 -0.97 . . . . 0.0 111.483 -179.213 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.358 0 CA-C-N 119.422 1.01 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 7.5 p . . . . . 0 N--CA 1.485 1.324 0 CA-C-O 120.85 0.357 . . . . 0.0 111.217 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 55.1 ttp180 -167.89 -33.88 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.172 179.749 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.463 ' HD3' ' C ' ' A' ' 3' ' ' ARG . 4.1 tmt_? -51.34 130.22 26.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.67 0.271 . . . . 0.0 110.351 -179.977 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.936 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -140.51 -168.66 0.19 Allowed Pre-proline 0 CA--C 1.541 0.631 0 N-CA-C 112.016 0.376 . . . . 0.0 112.016 -179.626 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.936 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 87.9 Cg_exo -50.56 163.12 0.75 Allowed 'Trans proline' 0 C--N 1.364 1.383 0 C-N-CA 123.13 2.553 . . . . 0.0 113.83 -179.478 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.452 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 33.0 p-90 -69.89 -34.49 73.62 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 177.33 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.64 ' CE3' HD11 ' A' ' 11' ' ' LEU . 10.1 p-90 -81.59 -17.51 48.02 Favored 'General case' 0 CA--C 1.496 -1.117 0 CA-C-N 114.976 -1.011 . . . . 0.0 111.11 178.591 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.621 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 42.8 t-105 -58.44 -46.25 99.63 Favored Pre-proline 0 N--CA 1.425 -1.712 0 C-N-CA 119.215 -0.994 . . . . 0.0 112.552 -177.113 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.826 ' HA ' ' HB3' ' A' ' 13' ' ' ARG . 74.3 Cg_exo -40.54 -50.81 3.69 Favored 'Trans proline' 0 N--CA 1.456 -0.684 0 C-N-CA 122.317 2.012 . . . . 0.0 112.766 -178.467 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -55.09 -37.11 66.38 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.38 0.609 . . . . 0.0 109.373 179.445 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.64 HD11 ' CE3' ' A' ' 7' ' ' TRP . 7.1 mt -62.88 -40.54 97.84 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.067 -0.97 . . . . 0.0 111.225 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 43.3 ttt85 -150.48 -51.59 0.14 Allowed 'General case' 0 CA--C 1.53 0.173 0 N-CA-C 112.002 0.371 . . . . 0.0 112.002 -179.016 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.826 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 12.1 tpt180 -73.34 47.6 0.22 Allowed 'General case' 0 C--O 1.249 1.044 0 CA-C-O 118.06 -0.972 . . . . 0.0 111.179 -179.723 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.311 1 O-C-N 85.524 -23.235 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 55.4 t . . . . . 0 N--CA 1.485 1.283 0 CA-C-O 120.784 0.326 . . . . 0.0 111.045 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 40.0 ttm180 -170.23 -40.17 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.126 179.898 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 25.6 mtm105 -46.88 138.25 6.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.882 0.372 . . . . 0.0 111.577 -179.386 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.895 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -146.19 -165.38 0.1 Allowed Pre-proline 0 CA--C 1.542 0.664 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.004 179.706 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.895 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 82.4 Cg_exo -49.11 157.23 1.89 Allowed 'Trans proline' 0 C--N 1.366 1.489 0 C-N-CA 122.544 2.162 . . . . 0.0 113.316 -179.801 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.449 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 35.2 p-90 -64.44 -33.97 77.1 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 177.54 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.689 ' CE3' HD11 ' A' ' 11' ' ' LEU . 9.8 p-90 -81.68 -16.21 52.02 Favored 'General case' 0 CA--C 1.499 -1.011 0 CA-C-N 115.05 -0.977 . . . . 0.0 111.146 178.565 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.637 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 33.9 t-105 -59.4 -47.03 98.87 Favored Pre-proline 0 N--CA 1.429 -1.509 0 C-N-CA 119.377 -0.929 . . . . 0.0 113.06 -176.889 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.572 ' HA ' ' HB3' ' A' ' 13' ' ' ARG . 72.3 Cg_exo -41.86 -46.02 6.75 Favored 'Trans proline' 0 N--CA 1.458 -0.572 0 C-N-CA 122.224 1.949 . . . . 0.0 112.693 -178.463 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -59.4 -37.15 77.27 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.344 0.593 . . . . 0.0 109.788 179.616 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.689 HD11 ' CE3' ' A' ' 7' ' ' TRP . 10.9 mt -58.76 -42.88 89.94 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.065 -0.97 . . . . 0.0 112.253 -179.095 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.451 ' HG2' HH11 ' A' ' 12' ' ' ARG . 65.5 mtt-85 -136.51 -49.3 0.65 Allowed 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 112.474 0.546 . . . . 0.0 112.474 -178.665 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.572 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 29.6 tpt180 -64.84 6.94 0.19 Allowed 'General case' 0 C--O 1.249 1.031 0 CA-C-O 118.333 -0.841 . . . . 0.0 110.933 -179.688 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.325 1 O-C-N 87.761 -21.837 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 27.7 m . . . . . 0 N--CA 1.486 1.327 0 CA-C-O 120.817 0.342 . . . . 0.0 111.282 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 60.8 mtt85 -52.11 131.74 32.36 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.528 179.797 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 27.1 ttt85 -173.95 45.93 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.967 0.413 . . . . 0.0 110.757 -179.379 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.936 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -161.4 -169.17 0.22 Allowed Pre-proline 0 CA--C 1.54 0.591 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -179.769 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.936 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 87.7 Cg_exo -49.23 159.37 1.15 Allowed 'Trans proline' 0 C--N 1.363 1.325 0 C-N-CA 123.194 2.596 . . . . 0.0 113.863 -179.212 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 34.2 p-90 -66.31 -32.35 73.7 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 177.531 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.672 ' CE3' HD11 ' A' ' 11' ' ' LEU . 11.0 p-90 -85.03 -17.3 37.94 Favored 'General case' 0 CA--C 1.499 -1.009 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.322 178.881 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.658 ' N ' ' HD2' ' A' ' 9' ' ' PRO . 25.4 t-105 -60.13 -44.82 97.4 Favored Pre-proline 0 N--CA 1.427 -1.591 0 C-N-CA 119.364 -0.934 . . . . 0.0 113.135 -176.713 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.658 ' HD2' ' N ' ' A' ' 8' ' ' TRP . 1.2 Cg_endo -45.71 -43.02 19.15 Favored 'Trans proline' 0 C--N 1.349 0.565 0 C-N-CA 121.981 1.788 . . . . 0.0 112.483 -178.453 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.4 ' H ' ' HD1' ' A' ' 10' ' ' TYR . 6.4 m-85 -57.64 -36.4 71.8 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 178.801 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.672 HD11 ' CE3' ' A' ' 7' ' ' TRP . 5.4 mt -67.08 -66.19 0.59 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 114.702 -1.136 . . . . 0.0 111.469 -179.707 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 30.4 tpt180 -87.91 -57.26 3.0 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 115.936 -0.574 . . . . 0.0 112.238 -178.727 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 27.8 mmm180 -62.59 -6.12 3.22 Favored 'General case' 0 C--O 1.25 1.086 0 CA-C-O 118.094 -0.955 . . . . 0.0 111.218 -179.339 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 119.662 1.119 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 47.5 t . . . . . 0 N--CA 1.485 1.31 0 CA-C-O 120.735 0.303 . . . . 0.0 110.989 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.492 ' HG2' HH11 ' A' ' 2' ' ' ARG . 62.2 mtt-85 -78.57 40.47 0.37 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.294 -179.917 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 29.1 tpt180 -66.4 136.26 55.49 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.497 -0.319 . . . . 0.0 110.609 179.567 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.888 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -143.84 -168.56 0.19 Allowed Pre-proline 0 CA--C 1.539 0.521 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.615 179.885 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.888 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 83.6 Cg_exo -49.8 162.88 0.59 Allowed 'Trans proline' 0 C--N 1.362 1.245 0 C-N-CA 122.939 2.426 . . . . 0.0 113.471 -179.562 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.475 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 41.5 p-90 -70.05 -32.78 71.05 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 177.413 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.66 ' CE3' HD11 ' A' ' 11' ' ' LEU . 10.8 p-90 -83.77 -16.71 43.72 Favored 'General case' 0 CA--C 1.497 -1.095 0 CA-C-N 114.917 -1.038 . . . . 0.0 111.369 178.842 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.66 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 33.6 t-105 -60.74 -44.54 95.45 Favored Pre-proline 0 N--CA 1.423 -1.798 0 C-N-CA 119.261 -0.976 . . . . 0.0 112.463 -177.114 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.58 ' HD3' ' O ' ' A' ' 5' ' ' PRO . 80.4 Cg_exo -43.03 -44.83 9.46 Favored 'Trans proline' 0 N--CA 1.46 -0.457 0 C-N-CA 122.268 1.979 . . . . 0.0 112.767 -178.565 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -60.94 -35.57 77.07 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.499 0.666 . . . . 0.0 109.501 179.361 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.66 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 9.8 mt -61.87 -53.04 61.3 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 114.858 -1.065 . . . . 0.0 112.235 -179.211 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 47.5 ttm-85 -117.29 -49.46 2.58 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 112.323 0.49 . . . . 0.0 112.323 -178.353 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.442 ' C ' ' HD2' ' A' ' 13' ' ' ARG . 4.5 tmm_? -62.56 -5.8 2.92 Favored 'General case' 0 C--O 1.249 1.052 0 CA-C-O 118.04 -0.981 . . . . 0.0 110.916 -179.29 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.309 1 O-C-N 86.157 -22.839 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 7.2 p . . . . . 0 N--CA 1.485 1.318 0 CA-C-O 120.882 0.373 . . . . 0.0 111.145 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.536 ' HB3' ' CE2' ' A' ' 4' ' ' TYR . 51.4 ttt-85 -71.1 153.32 42.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.672 -179.95 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 21.2 tpp180 -88.33 47.86 1.56 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.235 -179.618 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.899 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -68.28 -166.95 0.04 OUTLIER Pre-proline 0 CA--C 1.542 0.67 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.298 179.873 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.899 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 85.4 Cg_exo -48.8 161.52 0.48 Allowed 'Trans proline' 0 C--N 1.367 1.533 0 C-N-CA 122.723 2.282 . . . . 0.0 113.431 -179.931 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.471 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 38.4 p-90 -68.22 -33.52 74.56 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 177.457 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.669 ' CE3' HD11 ' A' ' 11' ' ' LEU . 9.2 p-90 -82.32 -17.38 45.95 Favored 'General case' 0 CA--C 1.497 -1.092 0 CA-C-N 114.94 -1.027 . . . . 0.0 111.119 178.724 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.641 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 33.4 t-105 -58.66 -46.26 99.59 Favored Pre-proline 0 N--CA 1.427 -1.577 0 C-N-CA 119.405 -0.918 . . . . 0.0 112.408 -177.236 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.537 ' HD3' ' O ' ' A' ' 5' ' ' PRO . 81.5 Cg_exo -41.16 -46.85 5.34 Favored 'Trans proline' 0 N--CA 1.459 -0.521 0 C-N-CA 122.439 2.093 . . . . 0.0 112.661 -178.921 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.408 ' HD1' ' O ' ' A' ' 7' ' ' TRP . 7.1 m-85 -58.9 -37.15 75.97 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 179.311 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.669 HD11 ' CE3' ' A' ' 7' ' ' TRP . 5.9 mt -65.3 -70.28 0.24 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.749 -179.572 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 29.7 tpt180 -87.11 -56.23 3.47 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.921 -0.582 . . . . 0.0 112.184 -178.466 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.473 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 30.1 tpt180 -64.89 3.81 0.51 Allowed 'General case' 0 C--O 1.249 1.05 0 CA-C-O 118.005 -0.998 . . . . 0.0 111.168 -179.547 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.324 1 O-C-N 88.925 -21.109 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' VAL . . . . . 0.442 HG23 ' N ' ' A' ' 2' ' ' ARG . 23.0 m . . . . . 0 N--CA 1.485 1.29 0 CA-C-O 120.647 0.26 . . . . 0.0 111.307 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.442 ' N ' HG23 ' A' ' 1' ' ' VAL . 14.5 ptp180 -175.52 51.71 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.956 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.438 ' HG2' HH11 ' A' ' 3' ' ' ARG . 14.9 tpp85 -50.78 -42.18 57.68 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.902 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.927 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -63.07 -169.62 0.04 OUTLIER Pre-proline 0 CA--C 1.541 0.607 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.773 179.946 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.927 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 80.8 Cg_exo -50.21 164.45 0.47 Allowed 'Trans proline' 0 C--N 1.362 1.275 0 C-N-CA 123.041 2.494 . . . . 0.0 113.58 -179.56 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.479 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 34.1 p-90 -71.14 -33.49 70.12 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 177.392 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.652 ' CH2' ' HG2' ' A' ' 5' ' ' PRO . 10.6 p-90 -83.28 -17.22 43.36 Favored 'General case' 0 CA--C 1.496 -1.112 0 CA-C-N 114.937 -1.029 . . . . 0.0 111.374 178.866 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.664 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 29.8 t-105 -60.9 -44.31 94.35 Favored Pre-proline 0 N--CA 1.424 -1.748 0 C-N-CA 119.162 -1.015 . . . . 0.0 112.471 -176.993 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.833 ' HA ' ' HB3' ' A' ' 13' ' ' ARG . 81.3 Cg_exo -42.95 -47.53 8.21 Favored 'Trans proline' 0 N--CA 1.459 -0.516 0 C-N-CA 122.108 1.872 . . . . 0.0 112.687 -178.488 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -57.62 -36.52 71.91 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.444 0.64 . . . . 0.0 109.303 179.201 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.664 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 9.3 mt -61.35 -39.11 89.38 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 114.892 -1.049 . . . . 0.0 111.603 -179.805 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 36.5 ttm180 -150.61 -50.86 0.13 Allowed 'General case' 0 CA--C 1.529 0.164 0 N-CA-C 112.103 0.408 . . . . 0.0 112.103 -178.79 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.833 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 5.9 tpm_? -72.09 44.74 0.11 Allowed 'General case' 0 C--O 1.249 1.034 0 CA-C-O 118.108 -0.949 . . . . 0.0 111.276 -179.555 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.34 1 O-C-N 85.565 -23.21 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.903 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.541 0.624 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.903 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 99.6 Cg_exo -48.78 163.13 0.31 Allowed 'Trans proline' 0 C--N 1.363 1.342 0 C-N-CA 122.942 2.428 . . . . 0.0 113.557 -179.579 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.45 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 35.9 p-90 -70.09 -33.53 72.0 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 177.541 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.633 ' CH2' ' HG2' ' A' ' 5' ' ' PRO . 11.6 p-90 -83.76 -16.88 43.11 Favored 'General case' 0 CA--C 1.498 -1.054 0 CA-C-N 114.845 -1.07 . . . . 0.0 111.566 178.923 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.663 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 29.0 t-105 -61.05 -44.84 95.7 Favored Pre-proline 0 N--CA 1.426 -1.663 0 C-N-CA 119.271 -0.972 . . . . 0.0 112.548 -176.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.783 ' HA ' ' HB3' ' A' ' 13' ' ' ARG . 81.8 Cg_exo -43.36 -47.48 9.01 Favored 'Trans proline' 0 N--CA 1.46 -0.493 0 C-N-CA 122.129 1.886 . . . . 0.0 112.87 -178.404 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -58.04 -35.23 71.0 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.463 0.649 . . . . 0.0 109.329 179.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.663 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 9.6 mt -62.25 -41.31 98.33 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 114.889 -1.051 . . . . 0.0 111.766 -179.613 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 53.4 ttt-85 -146.2 -47.79 0.2 Allowed 'General case' 0 CA--C 1.529 0.145 0 N-CA-C 112.257 0.466 . . . . 0.0 112.257 -178.523 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.783 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 3.3 tmt_? . . . . . 0 C--O 1.249 1.028 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.891 -179.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.926 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.542 0.672 0 N-CA-C 111.903 0.335 . . . . 0.0 111.903 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.926 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 92.0 Cg_exo -48.53 156.8 1.65 Allowed 'Trans proline' 0 C--N 1.364 1.376 0 C-N-CA 122.736 2.291 . . . . 0.0 113.511 -179.616 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 35.3 p-90 -64.35 -32.0 73.44 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 177.669 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.657 ' CE3' HD11 ' A' ' 11' ' ' LEU . 11.4 p-90 -84.99 -17.62 37.03 Favored 'General case' 0 CA--C 1.499 -0.989 0 CA-C-N 115.13 -0.941 . . . . 0.0 111.591 179.074 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.665 ' N ' ' HD2' ' A' ' 9' ' ' PRO . 26.4 t-105 -60.18 -44.15 95.61 Favored Pre-proline 0 N--CA 1.428 -1.559 0 C-N-CA 119.291 -0.964 . . . . 0.0 113.293 -176.576 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.84 ' HA ' ' HB3' ' A' ' 13' ' ' ARG . 2.1 Cg_endo -46.68 -44.55 21.5 Favored 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.05 1.834 . . . . 0.0 112.758 -178.231 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -59.78 -33.94 72.35 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 179.135 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.657 HD11 ' CE3' ' A' ' 7' ' ' TRP . 11.9 mt -62.28 -44.19 97.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 114.952 -1.022 . . . . 0.0 112.138 -179.498 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 79.5 ttt180 -139.57 -46.21 0.45 Allowed 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 112.222 0.452 . . . . 0.0 112.222 -178.438 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.84 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 11.7 tpt180 . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.098 -0.953 . . . . 0.0 111.389 -179.722 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.889 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.542 0.641 0 N-CA-C 111.528 0.195 . . . . 0.0 111.528 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.889 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 83.1 Cg_exo -49.34 161.66 0.65 Allowed 'Trans proline' 0 C--N 1.363 1.331 0 C-N-CA 122.793 2.329 . . . . 0.0 113.371 -179.804 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.498 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 40.1 p-90 -68.64 -33.69 74.45 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 108.069 -1.085 . . . . 0.0 108.069 177.425 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.67 ' CE3' HD11 ' A' ' 11' ' ' LEU . 11.4 p-90 -82.55 -15.48 52.16 Favored 'General case' 0 CA--C 1.495 -1.144 0 CA-C-N 114.883 -1.053 . . . . 0.0 111.311 178.749 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.653 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 29.5 t-105 -61.56 -45.46 93.78 Favored Pre-proline 0 N--CA 1.425 -1.707 0 C-N-CA 119.355 -0.938 . . . . 0.0 112.741 -176.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.578 ' HD3' ' O ' ' A' ' 5' ' ' PRO . 82.3 Cg_exo -43.8 -44.14 11.68 Favored 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.234 1.956 . . . . 0.0 112.905 -178.511 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -61.64 -34.83 76.38 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.384 0.611 . . . . 0.0 109.595 179.418 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.67 HD11 ' CE3' ' A' ' 7' ' ' TRP . 12.5 mt -59.47 -46.62 88.26 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 114.958 -1.019 . . . . 0.0 112.196 -179.297 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.402 ' HG2' HH11 ' A' ' 12' ' ' ARG . 43.3 mtp85 -129.69 -47.49 1.15 Allowed 'General case' 0 C--N 1.332 -0.155 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -178.698 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.416 ' HB2' ' HA ' ' A' ' 9' ' ' PRO . 40.0 mmm-85 . . . . . 0 C--O 1.25 1.107 0 CA-C-O 118.116 -0.945 . . . . 0.0 110.741 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.943 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.54 0.587 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.943 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 97.0 Cg_exo -48.7 166.94 0.13 Allowed 'Trans proline' 0 C--N 1.365 1.431 0 C-N-CA 123.08 2.52 . . . . 0.0 113.635 -179.429 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.451 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 33.9 p-90 -72.75 -34.27 66.91 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 177.43 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.666 ' CH2' ' HG2' ' A' ' 5' ' ' PRO . 10.9 p-90 -83.19 -17.33 43.23 Favored 'General case' 0 CA--C 1.498 -1.041 0 CA-C-N 114.813 -1.085 . . . . 0.0 111.604 178.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.66 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 26.8 t-105 -61.57 -45.25 93.7 Favored Pre-proline 0 N--CA 1.425 -1.71 0 C-N-CA 119.279 -0.969 . . . . 0.0 112.612 -176.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.593 ' HA ' ' HB3' ' A' ' 13' ' ' ARG . 99.8 Cg_exo -42.73 -43.34 8.83 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.444 2.096 . . . . 0.0 113.098 -178.333 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 4.7 m-85 -63.48 -35.42 80.38 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.478 0.656 . . . . 0.0 109.603 179.404 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.66 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 10.7 mt -60.33 -50.91 71.76 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.839 -1.073 . . . . 0.0 112.387 -179.198 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 44.2 ttt85 -125.27 -46.71 1.77 Allowed 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -178.239 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.593 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 12.0 tpt180 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.005 -0.998 . . . . 0.0 111.276 -179.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.922 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.541 0.619 0 CA-C-O 119.617 -0.23 . . . . 0.0 111.129 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.922 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 93.4 Cg_exo -47.96 157.77 1.01 Allowed 'Trans proline' 0 C--N 1.366 1.488 0 C-N-CA 122.438 2.092 . . . . 0.0 113.057 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.493 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 42.0 p-90 -64.93 -33.14 75.33 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 177.62 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.671 ' CE3' HD11 ' A' ' 11' ' ' LEU . 11.9 p-90 -83.19 -14.56 53.13 Favored 'General case' 0 CA--C 1.497 -1.058 0 CA-C-N 115.009 -0.996 . . . . 0.0 111.439 178.734 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.634 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 32.6 t-105 -61.35 -45.81 94.88 Favored Pre-proline 0 N--CA 1.427 -1.597 0 C-N-CA 119.195 -1.002 . . . . 0.0 112.352 -177.273 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.581 ' HD3' ' O ' ' A' ' 5' ' ' PRO . 85.1 Cg_exo -43.97 -44.13 12.17 Favored 'Trans proline' 0 C--N 1.348 0.508 0 C-N-CA 122.111 1.874 . . . . 0.0 112.314 -178.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -59.75 -36.95 77.68 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 179.137 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.671 HD11 ' CE3' ' A' ' 7' ' ' TRP . 9.3 mt -63.15 -68.15 0.36 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 114.983 -1.008 . . . . 0.0 111.637 -179.704 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.583 ' HG3' ' HE1' ' A' ' 8' ' ' TRP . 13.4 mmp_? -92.4 -55.59 3.35 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -178.799 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.459 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 32.4 tpt85 . . . . . 0 C--O 1.249 1.052 0 CA-C-O 117.966 -1.016 . . . . 0.0 111.32 -179.258 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.865 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.54 0.586 0 N-CA-C 111.638 0.236 . . . . 0.0 111.638 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.865 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 79.9 Cg_exo -49.59 160.46 1.07 Allowed 'Trans proline' 0 C--N 1.364 1.351 0 C-N-CA 122.773 2.315 . . . . 0.0 113.333 -179.751 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.508 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 32.4 p-90 -67.82 -33.11 74.15 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 177.401 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.662 ' CE3' HD11 ' A' ' 11' ' ' LEU . 10.9 p-90 -83.01 -15.91 49.24 Favored 'General case' 0 CA--C 1.496 -1.117 0 CA-C-N 114.985 -1.007 . . . . 0.0 111.233 178.748 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.632 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 29.4 t-105 -61.2 -44.8 94.79 Favored Pre-proline 0 N--CA 1.426 -1.666 0 C-N-CA 119.408 -0.917 . . . . 0.0 112.649 -177.088 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.599 ' HD3' ' O ' ' A' ' 5' ' ' PRO . 88.5 Cg_exo -42.91 -45.68 8.95 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.316 2.011 . . . . 0.0 112.758 -178.653 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 7.4 m-85 -59.23 -36.31 75.21 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.399 0.618 . . . . 0.0 109.392 179.285 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.662 HD11 ' CE3' ' A' ' 7' ' ' TRP . 7.5 mt -64.01 -70.17 0.24 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.959 -1.018 . . . . 0.0 111.665 -179.668 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 54.4 ttt-85 -86.92 -56.32 3.44 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 115.94 -0.573 . . . . 0.0 112.067 -178.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.418 HH11 ' HG3' ' A' ' 13' ' ' ARG . 43.7 mmm-85 . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.089 -0.958 . . . . 0.0 111.282 -179.465 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.937 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.542 0.64 0 CA-C-O 119.861 -0.114 . . . . 0.0 111.131 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.937 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 88.3 Cg_exo -48.99 154.41 3.29 Favored 'Trans proline' 0 C--N 1.363 1.302 0 C-N-CA 122.579 2.186 . . . . 0.0 113.209 -179.786 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 42.6 p-90 -61.83 -32.58 72.91 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 177.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.669 ' CE3' HD11 ' A' ' 11' ' ' LEU . 11.9 p-90 -84.57 -17.32 39.18 Favored 'General case' 0 CA--C 1.499 -0.991 0 CA-C-N 115.05 -0.977 . . . . 0.0 111.814 179.074 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.673 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 25.8 t-105 -60.3 -44.96 97.45 Favored Pre-proline 0 N--CA 1.428 -1.552 0 C-N-CA 119.254 -0.978 . . . . 0.0 113.548 -176.461 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.66 ' HD2' ' N ' ' A' ' 8' ' ' TRP . 1.2 Cg_endo -45.67 -44.28 17.78 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.175 1.916 . . . . 0.0 112.802 -178.099 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -60.94 -33.74 73.64 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.371 0.605 . . . . 0.0 109.463 179.279 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.673 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 12.9 mt -60.85 -49.17 78.57 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 114.955 -1.02 . . . . 0.0 112.262 -179.198 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 79.3 ttt180 -130.11 -46.26 1.12 Allowed 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -178.336 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.532 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 28.5 tpt180 . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.335 -0.841 . . . . 0.0 111.526 -179.171 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.875 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.539 0.531 0 N-CA-C 111.585 0.217 . . . . 0.0 111.585 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.875 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 80.9 Cg_exo -49.98 164.36 0.43 Allowed 'Trans proline' 0 C--N 1.362 1.239 0 C-N-CA 123.065 2.51 . . . . 0.0 113.708 -179.421 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.494 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 34.5 p-90 -71.03 -33.51 70.38 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 177.348 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.649 ' CH2' ' HG2' ' A' ' 5' ' ' PRO . 10.7 p-90 -83.18 -15.93 48.61 Favored 'General case' 0 CA--C 1.497 -1.081 0 CA-C-N 114.836 -1.074 . . . . 0.0 111.2 178.622 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.662 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 29.1 t-105 -61.61 -44.81 92.86 Favored Pre-proline 0 N--CA 1.426 -1.657 0 C-N-CA 119.281 -0.968 . . . . 0.0 112.42 -177.159 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.577 ' HD3' ' O ' ' A' ' 5' ' ' PRO . 80.7 Cg_exo -43.17 -44.66 9.83 Favored 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 122.308 2.005 . . . . 0.0 112.459 -178.606 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -59.93 -37.74 80.35 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 179.134 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.662 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 6.9 mt -63.34 -68.58 0.33 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 114.951 -1.022 . . . . 0.0 111.513 -179.79 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 12.1 tpt180 -86.12 -59.0 2.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.79 -0.641 . . . . 0.0 112.028 -178.735 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 37.0 mmt180 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.083 -0.96 . . . . 0.0 111.424 -179.209 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.938 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.54 0.576 0 N-CA-C 111.339 0.125 . . . . 0.0 111.339 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.938 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 97.9 Cg_exo -48.23 156.1 1.73 Allowed 'Trans proline' 0 C--N 1.364 1.349 0 C-N-CA 122.669 2.246 . . . . 0.0 113.328 -179.649 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 38.6 p-90 -63.55 -31.59 72.8 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 177.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.644 ' CE3' HD11 ' A' ' 11' ' ' LEU . 11.5 p-90 -85.61 -18.0 34.57 Favored 'General case' 0 CA--C 1.499 -0.989 0 CA-C-N 115.088 -0.96 . . . . 0.0 111.75 179.086 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.656 ' N ' ' HD2' ' A' ' 9' ' ' PRO . 25.6 t-105 -59.8 -44.27 96.79 Favored Pre-proline 0 N--CA 1.428 -1.532 0 C-N-CA 119.349 -0.94 . . . . 0.0 113.156 -176.598 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.656 ' HD2' ' N ' ' A' ' 8' ' ' TRP . 1.8 Cg_endo -46.96 -43.91 23.65 Favored 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 121.934 1.756 . . . . 0.0 112.34 -178.41 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -58.7 -35.1 72.1 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 178.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.644 HD11 ' CE3' ' A' ' 7' ' ' TRP . 9.1 mt -65.45 -70.07 0.26 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 114.793 -1.094 . . . . 0.0 111.551 -179.694 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 78.3 ttt180 -86.75 -56.2 3.51 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.953 -0.567 . . . . 0.0 112.006 -179.074 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 37.5 mmt180 . . . . . 0 C--O 1.25 1.093 0 CA-C-O 118.076 -0.964 . . . . 0.0 111.499 -179.182 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.936 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.541 0.626 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.936 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 88.7 Cg_exo -50.74 159.66 2.19 Favored 'Trans proline' 0 C--N 1.361 1.211 0 C-N-CA 123.095 2.53 . . . . 0.0 113.721 -179.466 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 45.8 p-90 -66.93 -31.4 71.96 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 177.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.642 ' CE3' HD11 ' A' ' 11' ' ' LEU . 10.6 p-90 -85.67 -17.37 36.24 Favored 'General case' 0 CA--C 1.496 -1.1 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.468 179.059 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.681 ' N ' ' HD2' ' A' ' 9' ' ' PRO . 25.2 t-105 -60.2 -43.9 94.89 Favored Pre-proline 0 N--CA 1.424 -1.735 0 C-N-CA 119.11 -1.036 . . . . 0.0 113.048 -176.871 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.681 ' HD2' ' N ' ' A' ' 8' ' ' TRP . 1.8 Cg_endo -46.09 -43.13 20.83 Favored 'Trans proline' 0 N--CA 1.459 -0.51 0 C-N-CA 122.169 1.913 . . . . 0.0 112.625 -178.355 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 -61.66 -33.72 74.46 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.424 0.63 . . . . 0.0 109.31 179.162 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.681 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 12.8 mt -61.56 -48.19 82.11 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 114.929 -1.032 . . . . 0.0 112.188 -179.383 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 56.6 ttp85 -127.88 -48.17 1.37 Allowed 'General case' 0 C--O 1.231 0.126 0 N-CA-C 111.976 0.362 . . . . 0.0 111.976 -178.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.589 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 29.7 tpt180 . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.081 -0.962 . . . . 0.0 111.377 -179.686 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.883 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.541 0.622 0 CA-C-O 119.65 -0.214 . . . . 0.0 111.083 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.883 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 96.4 Cg_exo -48.03 158.15 0.95 Allowed 'Trans proline' 0 C--N 1.367 1.51 0 C-N-CA 122.527 2.151 . . . . 0.0 113.092 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.474 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 39.3 p-90 -65.07 -33.38 75.9 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 177.641 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.668 ' CE3' HD11 ' A' ' 11' ' ' LEU . 12.1 p-90 -83.44 -15.82 48.15 Favored 'General case' 0 CA--C 1.497 -1.067 0 CA-C-N 115.117 -0.947 . . . . 0.0 111.541 178.93 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.623 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 32.9 t-105 -60.63 -44.74 96.28 Favored Pre-proline 0 N--CA 1.426 -1.656 0 C-N-CA 119.284 -0.967 . . . . 0.0 112.446 -177.105 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.835 ' HA ' ' HB3' ' A' ' 13' ' ' ARG . 84.3 Cg_exo -43.66 -47.53 9.51 Favored 'Trans proline' 0 N--CA 1.458 -0.562 0 C-N-CA 122.103 1.869 . . . . 0.0 112.621 -178.859 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -56.77 -35.48 68.73 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.443 0.639 . . . . 0.0 109.517 179.262 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.668 HD11 ' CE3' ' A' ' 7' ' ' TRP . 10.1 mt -62.21 -43.83 97.95 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 114.882 -1.054 . . . . 0.0 111.874 -179.312 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 74.5 mtp180 -141.77 -48.91 0.38 Allowed 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -178.825 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.835 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.034 -0.984 . . . . 0.0 110.637 -179.694 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.911 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.542 0.655 0 N-CA-C 111.391 0.145 . . . . 0.0 111.391 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.911 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 81.0 Cg_exo -48.9 158.14 1.36 Allowed 'Trans proline' 0 C--N 1.365 1.399 0 C-N-CA 122.635 2.223 . . . . 0.0 113.342 -179.794 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.449 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 39.4 p-90 -65.48 -33.68 76.5 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 177.564 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.69 ' CE3' HD11 ' A' ' 11' ' ' LEU . 9.9 p-90 -81.93 -17.69 46.23 Favored 'General case' 0 CA--C 1.497 -1.09 0 CA-C-N 115.078 -0.964 . . . . 0.0 111.178 178.557 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.651 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 35.4 t-105 -57.41 -46.49 99.8 Favored Pre-proline 0 N--CA 1.428 -1.546 0 C-N-CA 119.518 -0.873 . . . . 0.0 112.781 -176.948 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.897 ' HA ' ' HB3' ' A' ' 13' ' ' ARG . 89.2 Cg_exo -41.31 -49.63 4.79 Favored 'Trans proline' 0 N--CA 1.458 -0.58 0 C-N-CA 122.266 1.977 . . . . 0.0 112.979 -178.546 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -57.68 -35.75 71.0 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.344 0.592 . . . . 0.0 109.695 179.662 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.69 HD11 ' CE3' ' A' ' 7' ' ' TRP . 10.1 mt -59.68 -41.53 90.87 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.829 -179.538 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 72.4 mtt-85 -146.16 -48.12 0.2 Allowed 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 112.381 0.512 . . . . 0.0 112.381 -178.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.897 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 30.7 tpt180 . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.039 -0.981 . . . . 0.0 110.927 -179.623 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.926 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.541 0.598 0 CA-C-O 119.803 -0.141 . . . . 0.0 111.313 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.926 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 90.9 Cg_exo -48.78 162.77 0.34 Allowed 'Trans proline' 0 C--N 1.365 1.396 0 C-N-CA 122.731 2.287 . . . . 0.0 113.429 -179.74 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.484 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 33.3 p-90 -69.31 -33.44 73.16 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 177.542 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.638 ' CH2' ' HG2' ' A' ' 5' ' ' PRO . 11.3 p-90 -83.65 -16.0 46.75 Favored 'General case' 0 CA--C 1.498 -1.04 0 CA-C-N 114.945 -1.025 . . . . 0.0 111.359 178.777 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.652 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 29.1 t-105 -61.32 -44.18 92.17 Favored Pre-proline 0 N--CA 1.426 -1.645 0 C-N-CA 119.336 -0.945 . . . . 0.0 112.611 -177.016 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.599 ' HD3' ' O ' ' A' ' 5' ' ' PRO . 86.2 Cg_exo -43.46 -49.4 7.66 Favored 'Trans proline' 0 N--CA 1.46 -0.491 0 C-N-CA 122.174 1.916 . . . . 0.0 112.541 -178.649 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 7.4 m-85 -56.16 -35.35 67.09 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 179.208 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.652 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 6.8 mt -65.93 -70.58 0.23 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.09 -0.959 . . . . 0.0 111.51 -179.795 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.591 ' HA ' ' HE ' ' A' ' 12' ' ' ARG . 5.3 tpm_? -83.08 -57.51 3.25 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.987 -178.809 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 29.0 tpt180 . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.297 -0.859 . . . . 0.0 111.029 -179.386 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.925 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.541 0.612 0 CA-C-O 119.637 -0.22 . . . . 0.0 110.884 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.925 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 94.0 Cg_exo -48.01 155.8 1.66 Allowed 'Trans proline' 0 C--N 1.367 1.527 0 C-N-CA 122.377 2.051 . . . . 0.0 113.067 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.438 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 31.0 p-90 -63.46 -33.8 76.37 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 177.53 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.708 ' CE3' HD11 ' A' ' 11' ' ' LEU . 9.7 p-90 -81.39 -16.78 51.15 Favored 'General case' 0 CA--C 1.499 -0.981 0 CA-C-N 114.986 -1.006 . . . . 0.0 111.278 178.618 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.641 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 37.6 t-105 -59.18 -47.25 98.75 Favored Pre-proline 0 N--CA 1.431 -1.378 0 C-N-CA 119.358 -0.937 . . . . 0.0 112.911 -176.822 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.499 ' HD3' ' O ' ' A' ' 5' ' ' PRO . 83.4 Cg_exo -41.33 -44.29 5.71 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.445 2.097 . . . . 0.0 112.704 -178.54 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -61.49 -37.39 83.48 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 179.38 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.708 HD11 ' CE3' ' A' ' 7' ' ' TRP . 8.0 mt -63.54 -68.55 0.34 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 114.976 -1.011 . . . . 0.0 112.052 -179.415 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.553 ' HA ' ' HE ' ' A' ' 12' ' ' ARG . 5.4 tpm_? -91.13 -55.55 3.49 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.028 -0.533 . . . . 0.0 112.362 -178.163 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 36.5 mmt180 . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.063 -0.97 . . . . 0.0 111.483 -179.213 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.936 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.541 0.631 0 N-CA-C 112.016 0.376 . . . . 0.0 112.016 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.936 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 87.9 Cg_exo -50.56 163.12 0.75 Allowed 'Trans proline' 0 C--N 1.364 1.383 0 C-N-CA 123.13 2.553 . . . . 0.0 113.83 -179.478 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.452 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 33.0 p-90 -69.89 -34.49 73.62 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 177.33 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.64 ' CE3' HD11 ' A' ' 11' ' ' LEU . 10.1 p-90 -81.59 -17.51 48.02 Favored 'General case' 0 CA--C 1.496 -1.117 0 CA-C-N 114.976 -1.011 . . . . 0.0 111.11 178.591 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.621 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 42.8 t-105 -58.44 -46.25 99.63 Favored Pre-proline 0 N--CA 1.425 -1.712 0 C-N-CA 119.215 -0.994 . . . . 0.0 112.552 -177.113 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.826 ' HA ' ' HB3' ' A' ' 13' ' ' ARG . 74.3 Cg_exo -40.54 -50.81 3.69 Favored 'Trans proline' 0 N--CA 1.456 -0.684 0 C-N-CA 122.317 2.012 . . . . 0.0 112.766 -178.467 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -55.09 -37.11 66.38 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.38 0.609 . . . . 0.0 109.373 179.445 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.64 HD11 ' CE3' ' A' ' 7' ' ' TRP . 7.1 mt -62.88 -40.54 97.84 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.067 -0.97 . . . . 0.0 111.225 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 43.3 ttt85 -150.48 -51.59 0.14 Allowed 'General case' 0 CA--C 1.53 0.173 0 N-CA-C 112.002 0.371 . . . . 0.0 112.002 -179.016 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.826 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 12.1 tpt180 . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.06 -0.972 . . . . 0.0 111.179 -179.723 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.895 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.542 0.664 0 CA-C-O 119.685 -0.198 . . . . 0.0 111.004 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.895 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 82.4 Cg_exo -49.11 157.23 1.89 Allowed 'Trans proline' 0 C--N 1.366 1.489 0 C-N-CA 122.544 2.162 . . . . 0.0 113.316 -179.801 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.449 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 35.2 p-90 -64.44 -33.97 77.1 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 177.54 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.689 ' CE3' HD11 ' A' ' 11' ' ' LEU . 9.8 p-90 -81.68 -16.21 52.02 Favored 'General case' 0 CA--C 1.499 -1.011 0 CA-C-N 115.05 -0.977 . . . . 0.0 111.146 178.565 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.637 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 33.9 t-105 -59.4 -47.03 98.87 Favored Pre-proline 0 N--CA 1.429 -1.509 0 C-N-CA 119.377 -0.929 . . . . 0.0 113.06 -176.889 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.572 ' HA ' ' HB3' ' A' ' 13' ' ' ARG . 72.3 Cg_exo -41.86 -46.02 6.75 Favored 'Trans proline' 0 N--CA 1.458 -0.572 0 C-N-CA 122.224 1.949 . . . . 0.0 112.693 -178.463 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -59.4 -37.15 77.27 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.344 0.593 . . . . 0.0 109.788 179.616 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.689 HD11 ' CE3' ' A' ' 7' ' ' TRP . 10.9 mt -58.76 -42.88 89.94 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.065 -0.97 . . . . 0.0 112.253 -179.095 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.451 ' HG2' HH11 ' A' ' 12' ' ' ARG . 65.5 mtt-85 -136.51 -49.3 0.65 Allowed 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 112.474 0.546 . . . . 0.0 112.474 -178.665 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.572 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 29.6 tpt180 . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.333 -0.841 . . . . 0.0 110.933 -179.688 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.936 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.54 0.591 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.936 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 87.7 Cg_exo -49.23 159.37 1.15 Allowed 'Trans proline' 0 C--N 1.363 1.325 0 C-N-CA 123.194 2.596 . . . . 0.0 113.863 -179.212 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 34.2 p-90 -66.31 -32.35 73.7 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 177.531 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.672 ' CE3' HD11 ' A' ' 11' ' ' LEU . 11.0 p-90 -85.03 -17.3 37.94 Favored 'General case' 0 CA--C 1.499 -1.009 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.322 178.881 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.658 ' N ' ' HD2' ' A' ' 9' ' ' PRO . 25.4 t-105 -60.13 -44.82 97.4 Favored Pre-proline 0 N--CA 1.427 -1.591 0 C-N-CA 119.364 -0.934 . . . . 0.0 113.135 -176.713 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.658 ' HD2' ' N ' ' A' ' 8' ' ' TRP . 1.2 Cg_endo -45.71 -43.02 19.15 Favored 'Trans proline' 0 C--N 1.349 0.565 0 C-N-CA 121.981 1.788 . . . . 0.0 112.483 -178.453 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.4 ' H ' ' HD1' ' A' ' 10' ' ' TYR . 6.4 m-85 -57.64 -36.4 71.8 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 178.801 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.672 HD11 ' CE3' ' A' ' 7' ' ' TRP . 5.4 mt -67.08 -66.19 0.59 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 114.702 -1.136 . . . . 0.0 111.469 -179.707 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 30.4 tpt180 -87.91 -57.26 3.0 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 115.936 -0.574 . . . . 0.0 112.238 -178.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 27.8 mmm180 . . . . . 0 C--O 1.25 1.086 0 CA-C-O 118.094 -0.955 . . . . 0.0 111.218 -179.339 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.888 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.539 0.521 0 N-CA-C 111.615 0.228 . . . . 0.0 111.615 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.888 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 83.6 Cg_exo -49.8 162.88 0.59 Allowed 'Trans proline' 0 C--N 1.362 1.245 0 C-N-CA 122.939 2.426 . . . . 0.0 113.471 -179.562 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.475 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 41.5 p-90 -70.05 -32.78 71.05 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 177.413 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.66 ' CE3' HD11 ' A' ' 11' ' ' LEU . 10.8 p-90 -83.77 -16.71 43.72 Favored 'General case' 0 CA--C 1.497 -1.095 0 CA-C-N 114.917 -1.038 . . . . 0.0 111.369 178.842 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.66 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 33.6 t-105 -60.74 -44.54 95.45 Favored Pre-proline 0 N--CA 1.423 -1.798 0 C-N-CA 119.261 -0.976 . . . . 0.0 112.463 -177.114 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.58 ' HD3' ' O ' ' A' ' 5' ' ' PRO . 80.4 Cg_exo -43.03 -44.83 9.46 Favored 'Trans proline' 0 N--CA 1.46 -0.457 0 C-N-CA 122.268 1.979 . . . . 0.0 112.767 -178.565 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -60.94 -35.57 77.07 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.499 0.666 . . . . 0.0 109.501 179.361 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.66 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 9.8 mt -61.87 -53.04 61.3 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 114.858 -1.065 . . . . 0.0 112.235 -179.211 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 47.5 ttm-85 -117.29 -49.46 2.58 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 112.323 0.49 . . . . 0.0 112.323 -178.353 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.442 ' C ' ' HD2' ' A' ' 13' ' ' ARG . 4.5 tmm_? . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.04 -0.981 . . . . 0.0 110.916 -179.29 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.899 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.542 0.67 0 N-CA-C 111.298 0.11 . . . . 0.0 111.298 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.899 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 85.4 Cg_exo -48.8 161.52 0.48 Allowed 'Trans proline' 0 C--N 1.367 1.533 0 C-N-CA 122.723 2.282 . . . . 0.0 113.431 -179.931 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.471 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 38.4 p-90 -68.22 -33.52 74.56 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 177.457 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.669 ' CE3' HD11 ' A' ' 11' ' ' LEU . 9.2 p-90 -82.32 -17.38 45.95 Favored 'General case' 0 CA--C 1.497 -1.092 0 CA-C-N 114.94 -1.027 . . . . 0.0 111.119 178.724 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.641 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 33.4 t-105 -58.66 -46.26 99.59 Favored Pre-proline 0 N--CA 1.427 -1.577 0 C-N-CA 119.405 -0.918 . . . . 0.0 112.408 -177.236 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.537 ' HD3' ' O ' ' A' ' 5' ' ' PRO . 81.5 Cg_exo -41.16 -46.85 5.34 Favored 'Trans proline' 0 N--CA 1.459 -0.521 0 C-N-CA 122.439 2.093 . . . . 0.0 112.661 -178.921 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.408 ' HD1' ' O ' ' A' ' 7' ' ' TRP . 7.1 m-85 -58.9 -37.15 75.97 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 179.311 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.669 HD11 ' CE3' ' A' ' 7' ' ' TRP . 5.9 mt -65.3 -70.28 0.24 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.749 -179.572 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 29.7 tpt180 -87.11 -56.23 3.47 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.921 -0.582 . . . . 0.0 112.184 -178.466 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.473 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 30.1 tpt180 . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.005 -0.998 . . . . 0.0 111.168 -179.547 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.927 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.541 0.607 0 N-CA-C 111.773 0.286 . . . . 0.0 111.773 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.927 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 80.8 Cg_exo -50.21 164.45 0.47 Allowed 'Trans proline' 0 C--N 1.362 1.275 0 C-N-CA 123.041 2.494 . . . . 0.0 113.58 -179.56 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.479 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 34.1 p-90 -71.14 -33.49 70.12 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 177.392 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.652 ' CH2' ' HG2' ' A' ' 5' ' ' PRO . 10.6 p-90 -83.28 -17.22 43.36 Favored 'General case' 0 CA--C 1.496 -1.112 0 CA-C-N 114.937 -1.029 . . . . 0.0 111.374 178.866 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.664 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 29.8 t-105 -60.9 -44.31 94.35 Favored Pre-proline 0 N--CA 1.424 -1.748 0 C-N-CA 119.162 -1.015 . . . . 0.0 112.471 -176.993 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.833 ' HA ' ' HB3' ' A' ' 13' ' ' ARG . 81.3 Cg_exo -42.95 -47.53 8.21 Favored 'Trans proline' 0 N--CA 1.459 -0.516 0 C-N-CA 122.108 1.872 . . . . 0.0 112.687 -178.488 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -57.62 -36.52 71.91 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.444 0.64 . . . . 0.0 109.303 179.201 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.664 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 9.3 mt -61.35 -39.11 89.38 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 114.892 -1.049 . . . . 0.0 111.603 -179.805 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 36.5 ttm180 -150.61 -50.86 0.13 Allowed 'General case' 0 CA--C 1.529 0.164 0 N-CA-C 112.103 0.408 . . . . 0.0 112.103 -178.79 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.833 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 5.9 tpm_? . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.108 -0.949 . . . . 0.0 111.276 -179.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 30.3 m . . . . . 0 N--CA 1.485 1.296 0 CA-C-O 120.917 0.389 . . . . 0.0 111.204 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.424 ' HB3' ' CE1' ' A' ' 4' ' ' TYR . 47.9 ttm-85 -65.07 -49.96 68.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.969 179.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.406 ' HG2' HH11 ' A' ' 3' ' ' ARG . 53.2 ttt-85 -174.9 -38.98 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.056 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.903 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -59.39 -169.53 0.02 OUTLIER Pre-proline 0 CA--C 1.541 0.624 0 CA-C-N 116.278 -0.419 . . . . 0.0 112.093 -179.532 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.903 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 99.6 Cg_exo -48.78 163.13 0.31 Allowed 'Trans proline' 0 C--N 1.363 1.342 0 C-N-CA 122.942 2.428 . . . . 0.0 113.557 -179.579 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.45 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 35.9 p-90 -70.09 -33.53 72.0 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 177.541 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.633 ' CH2' ' HG2' ' A' ' 5' ' ' PRO . 11.6 p-90 -83.76 -16.88 43.11 Favored 'General case' 0 CA--C 1.498 -1.054 0 CA-C-N 114.845 -1.07 . . . . 0.0 111.566 178.923 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.663 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 29.0 t-105 -61.05 -44.84 95.7 Favored Pre-proline 0 N--CA 1.426 -1.663 0 C-N-CA 119.271 -0.972 . . . . 0.0 112.548 -176.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.783 ' HA ' ' HB3' ' A' ' 13' ' ' ARG . 81.8 Cg_exo -43.36 -47.48 9.01 Favored 'Trans proline' 0 N--CA 1.46 -0.493 0 C-N-CA 122.129 1.886 . . . . 0.0 112.87 -178.404 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -58.04 -35.23 71.0 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.463 0.649 . . . . 0.0 109.329 179.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.663 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 9.6 mt -62.25 -41.31 98.33 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 114.889 -1.051 . . . . 0.0 111.766 -179.613 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 53.4 ttt-85 -146.2 -47.79 0.2 Allowed 'General case' 0 CA--C 1.529 0.145 0 N-CA-C 112.257 0.466 . . . . 0.0 112.257 -178.523 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.783 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 3.3 tmt_? -71.64 33.93 0.05 Allowed 'General case' 0 C--O 1.249 1.028 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.891 -179.4 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.273 1 O-C-N 78.809 -27.432 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 27.8 m . . . . . 0 N--CA 1.486 1.339 0 CA-C-O 120.945 0.402 . . . . 0.0 111.276 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.52 ' HB2' HH11 ' A' ' 13' ' ' ARG . 0.0 OUTLIER -62.27 -48.68 78.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.432 179.879 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 79.3 ttt180 -174.42 -41.49 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.759 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.926 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -60.75 -167.8 0.02 OUTLIER Pre-proline 0 CA--C 1.542 0.672 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.903 -179.796 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.926 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 92.0 Cg_exo -48.53 156.8 1.65 Allowed 'Trans proline' 0 C--N 1.364 1.376 0 C-N-CA 122.736 2.291 . . . . 0.0 113.511 -179.616 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 35.3 p-90 -64.35 -32.0 73.44 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 177.669 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.657 ' CE3' HD11 ' A' ' 11' ' ' LEU . 11.4 p-90 -84.99 -17.62 37.03 Favored 'General case' 0 CA--C 1.499 -0.989 0 CA-C-N 115.13 -0.941 . . . . 0.0 111.591 179.074 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.665 ' N ' ' HD2' ' A' ' 9' ' ' PRO . 26.4 t-105 -60.18 -44.15 95.61 Favored Pre-proline 0 N--CA 1.428 -1.559 0 C-N-CA 119.291 -0.964 . . . . 0.0 113.293 -176.576 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.84 ' HA ' ' HB3' ' A' ' 13' ' ' ARG . 2.1 Cg_endo -46.68 -44.55 21.5 Favored 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.05 1.834 . . . . 0.0 112.758 -178.231 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -59.78 -33.94 72.35 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 179.135 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.657 HD11 ' CE3' ' A' ' 7' ' ' TRP . 11.9 mt -62.28 -44.19 97.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 114.952 -1.022 . . . . 0.0 112.138 -179.498 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 79.5 ttt180 -139.57 -46.21 0.45 Allowed 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 112.222 0.452 . . . . 0.0 112.222 -178.438 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.84 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 11.7 tpt180 -70.85 34.7 0.05 OUTLIER 'General case' 0 C--O 1.249 1.036 0 CA-C-O 118.098 -0.953 . . . . 0.0 111.389 -179.722 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.342 1 O-C-N 85.39 -23.319 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 8.0 p . . . . . 0 N--CA 1.485 1.323 0 CA-C-O 120.799 0.333 . . . . 0.0 111.087 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -61.53 138.74 58.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.021 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.406 ' HG2' HH11 ' A' ' 3' ' ' ARG . 14.8 tpp85 -168.67 -43.29 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.152 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.889 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -63.97 -168.16 0.03 OUTLIER Pre-proline 0 CA--C 1.542 0.641 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.528 179.884 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.889 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 83.1 Cg_exo -49.34 161.66 0.65 Allowed 'Trans proline' 0 C--N 1.363 1.331 0 C-N-CA 122.793 2.329 . . . . 0.0 113.371 -179.804 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.498 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 40.1 p-90 -68.64 -33.69 74.45 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 108.069 -1.085 . . . . 0.0 108.069 177.425 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.67 ' CE3' HD11 ' A' ' 11' ' ' LEU . 11.4 p-90 -82.55 -15.48 52.16 Favored 'General case' 0 CA--C 1.495 -1.144 0 CA-C-N 114.883 -1.053 . . . . 0.0 111.311 178.749 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.653 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 29.5 t-105 -61.56 -45.46 93.78 Favored Pre-proline 0 N--CA 1.425 -1.707 0 C-N-CA 119.355 -0.938 . . . . 0.0 112.741 -176.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.578 ' HD3' ' O ' ' A' ' 5' ' ' PRO . 82.3 Cg_exo -43.8 -44.14 11.68 Favored 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.234 1.956 . . . . 0.0 112.905 -178.511 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -61.64 -34.83 76.38 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.384 0.611 . . . . 0.0 109.595 179.418 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.67 HD11 ' CE3' ' A' ' 7' ' ' TRP . 12.5 mt -59.47 -46.62 88.26 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 114.958 -1.019 . . . . 0.0 112.196 -179.297 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.402 ' HG2' HH11 ' A' ' 12' ' ' ARG . 43.3 mtp85 -129.69 -47.49 1.15 Allowed 'General case' 0 C--N 1.332 -0.155 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -178.698 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.416 ' HB2' ' HA ' ' A' ' 9' ' ' PRO . 40.0 mmm-85 -68.46 19.35 0.03 OUTLIER 'General case' 0 C--O 1.25 1.107 0 CA-C-O 118.116 -0.945 . . . . 0.0 110.741 -179.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.257 0 CA-C-N 119.176 0.898 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 27.8 m . . . . . 0 N--CA 1.485 1.295 0 CA-C-O 120.862 0.363 . . . . 0.0 111.23 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.426 ' HB2' ' CZ ' ' A' ' 4' ' ' TYR . 97.8 mtt180 -57.18 140.39 49.72 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.293 -179.658 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 82.0 mtm180 -95.6 135.51 37.17 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.609 179.675 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.943 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -162.94 -169.1 0.21 Allowed Pre-proline 0 CA--C 1.54 0.587 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 179.753 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.943 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 97.0 Cg_exo -48.7 166.94 0.13 Allowed 'Trans proline' 0 C--N 1.365 1.431 0 C-N-CA 123.08 2.52 . . . . 0.0 113.635 -179.429 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.451 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 33.9 p-90 -72.75 -34.27 66.91 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 177.43 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.666 ' CH2' ' HG2' ' A' ' 5' ' ' PRO . 10.9 p-90 -83.19 -17.33 43.23 Favored 'General case' 0 CA--C 1.498 -1.041 0 CA-C-N 114.813 -1.085 . . . . 0.0 111.604 178.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.66 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 26.8 t-105 -61.57 -45.25 93.7 Favored Pre-proline 0 N--CA 1.425 -1.71 0 C-N-CA 119.279 -0.969 . . . . 0.0 112.612 -176.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.593 ' HA ' ' HB3' ' A' ' 13' ' ' ARG . 99.8 Cg_exo -42.73 -43.34 8.83 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.444 2.096 . . . . 0.0 113.098 -178.333 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 4.7 m-85 -63.48 -35.42 80.38 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.478 0.656 . . . . 0.0 109.603 179.404 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.66 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 10.7 mt -60.33 -50.91 71.76 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.839 -1.073 . . . . 0.0 112.387 -179.198 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 44.2 ttt85 -125.27 -46.71 1.77 Allowed 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -178.239 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.593 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 12.0 tpt180 -63.23 4.97 0.17 Allowed 'General case' 0 C--O 1.249 1.043 0 CA-C-O 118.005 -0.998 . . . . 0.0 111.276 -179.438 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.343 1 O-C-N 87.176 -22.202 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 7.6 p . . . . . 0 N--CA 1.485 1.32 0 CA-C-O 120.616 0.246 . . . . 0.0 111.13 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 54.9 mmt-85 -60.02 -42.38 94.19 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.464 -0.335 . . . . 0.0 110.763 179.804 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 39.4 ttm180 -56.22 135.56 53.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.559 179.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.922 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -138.38 -163.7 0.06 OUTLIER Pre-proline 0 CA--C 1.541 0.619 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.129 -179.697 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.922 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 93.4 Cg_exo -47.96 157.77 1.01 Allowed 'Trans proline' 0 C--N 1.366 1.488 0 C-N-CA 122.438 2.092 . . . . 0.0 113.057 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.493 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 42.0 p-90 -64.93 -33.14 75.33 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 177.62 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.671 ' CE3' HD11 ' A' ' 11' ' ' LEU . 11.9 p-90 -83.19 -14.56 53.13 Favored 'General case' 0 CA--C 1.497 -1.058 0 CA-C-N 115.009 -0.996 . . . . 0.0 111.439 178.734 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.634 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 32.6 t-105 -61.35 -45.81 94.88 Favored Pre-proline 0 N--CA 1.427 -1.597 0 C-N-CA 119.195 -1.002 . . . . 0.0 112.352 -177.273 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.581 ' HD3' ' O ' ' A' ' 5' ' ' PRO . 85.1 Cg_exo -43.97 -44.13 12.17 Favored 'Trans proline' 0 C--N 1.348 0.508 0 C-N-CA 122.111 1.874 . . . . 0.0 112.314 -178.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -59.75 -36.95 77.68 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 179.137 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.671 HD11 ' CE3' ' A' ' 7' ' ' TRP . 9.3 mt -63.15 -68.15 0.36 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 114.983 -1.008 . . . . 0.0 111.637 -179.704 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.583 ' HG3' ' HE1' ' A' ' 8' ' ' TRP . 13.4 mmp_? -92.4 -55.59 3.35 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -178.799 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.459 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 32.4 tpt85 -62.84 3.42 0.23 Allowed 'General case' 0 C--O 1.249 1.052 0 CA-C-O 117.966 -1.016 . . . . 0.0 111.32 -179.258 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.341 1 O-C-N 96.323 -16.486 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . 0.486 ' O ' HG22 ' A' ' 1' ' ' VAL . 14.5 p . . . . . 0 N--CA 1.486 1.329 0 CA-C-O 121.415 0.626 . . . . 0.0 110.618 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 30.7 tpt180 -174.54 -53.11 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.752 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 39.4 mmt180 -93.87 37.8 1.08 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.036 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.865 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -65.13 -168.98 0.04 OUTLIER Pre-proline 0 CA--C 1.54 0.586 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.638 -179.899 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.865 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 79.9 Cg_exo -49.59 160.46 1.07 Allowed 'Trans proline' 0 C--N 1.364 1.351 0 C-N-CA 122.773 2.315 . . . . 0.0 113.333 -179.751 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.508 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 32.4 p-90 -67.82 -33.11 74.15 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 177.401 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.662 ' CE3' HD11 ' A' ' 11' ' ' LEU . 10.9 p-90 -83.01 -15.91 49.24 Favored 'General case' 0 CA--C 1.496 -1.117 0 CA-C-N 114.985 -1.007 . . . . 0.0 111.233 178.748 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.632 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 29.4 t-105 -61.2 -44.8 94.79 Favored Pre-proline 0 N--CA 1.426 -1.666 0 C-N-CA 119.408 -0.917 . . . . 0.0 112.649 -177.088 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.599 ' HD3' ' O ' ' A' ' 5' ' ' PRO . 88.5 Cg_exo -42.91 -45.68 8.95 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.316 2.011 . . . . 0.0 112.758 -178.653 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 7.4 m-85 -59.23 -36.31 75.21 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.399 0.618 . . . . 0.0 109.392 179.285 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.662 HD11 ' CE3' ' A' ' 7' ' ' TRP . 7.5 mt -64.01 -70.17 0.24 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.959 -1.018 . . . . 0.0 111.665 -179.668 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 54.4 ttt-85 -86.92 -56.32 3.44 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 115.94 -0.573 . . . . 0.0 112.067 -178.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.418 HH11 ' HG3' ' A' ' 13' ' ' ARG . 43.7 mmm-85 -66.83 3.45 1.05 Allowed 'General case' 0 C--O 1.249 1.078 0 CA-C-O 118.089 -0.958 . . . . 0.0 111.282 -179.465 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.333 1 O-C-N 102.107 -12.871 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 57.6 t . . . . . 0 N--CA 1.485 1.318 0 CA-C-O 120.844 0.354 . . . . 0.0 110.986 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.428 ' HG2' HH11 ' A' ' 2' ' ' ARG . 0.7 OUTLIER -76.12 148.63 37.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.935 179.748 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.417 ' HG2' HH11 ' A' ' 3' ' ' ARG . 51.6 ttt-85 -161.39 -45.92 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.181 179.888 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.937 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -64.89 -167.09 0.03 OUTLIER Pre-proline 0 CA--C 1.542 0.64 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.131 179.533 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.937 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 88.3 Cg_exo -48.99 154.41 3.29 Favored 'Trans proline' 0 C--N 1.363 1.302 0 C-N-CA 122.579 2.186 . . . . 0.0 113.209 -179.786 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 42.6 p-90 -61.83 -32.58 72.91 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 177.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.669 ' CE3' HD11 ' A' ' 11' ' ' LEU . 11.9 p-90 -84.57 -17.32 39.18 Favored 'General case' 0 CA--C 1.499 -0.991 0 CA-C-N 115.05 -0.977 . . . . 0.0 111.814 179.074 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.673 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 25.8 t-105 -60.3 -44.96 97.45 Favored Pre-proline 0 N--CA 1.428 -1.552 0 C-N-CA 119.254 -0.978 . . . . 0.0 113.548 -176.461 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.66 ' HD2' ' N ' ' A' ' 8' ' ' TRP . 1.2 Cg_endo -45.67 -44.28 17.78 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.175 1.916 . . . . 0.0 112.802 -178.099 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -60.94 -33.74 73.64 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.371 0.605 . . . . 0.0 109.463 179.279 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.673 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 12.9 mt -60.85 -49.17 78.57 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 114.955 -1.02 . . . . 0.0 112.262 -179.198 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 79.3 ttt180 -130.11 -46.26 1.12 Allowed 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -178.336 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.532 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 28.5 tpt180 -71.02 19.3 0.05 Allowed 'General case' 0 C--O 1.249 1.033 0 CA-C-O 118.335 -0.841 . . . . 0.0 111.526 -179.171 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.308 1 O-C-N 99.977 -14.202 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 11.6 p . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 120.799 0.333 . . . . 0.0 110.979 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 78.5 ttt180 -170.14 134.69 1.26 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.771 -179.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.576 ' HA ' ' NE ' ' A' ' 3' ' ' ARG . 5.6 tpm_? -168.31 43.97 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.044 0.45 . . . . 0.0 111.18 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.875 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -165.32 -170.91 0.24 Allowed Pre-proline 0 CA--C 1.539 0.531 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.585 179.133 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.875 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 80.9 Cg_exo -49.98 164.36 0.43 Allowed 'Trans proline' 0 C--N 1.362 1.239 0 C-N-CA 123.065 2.51 . . . . 0.0 113.708 -179.421 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.494 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 34.5 p-90 -71.03 -33.51 70.38 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 177.348 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.649 ' CH2' ' HG2' ' A' ' 5' ' ' PRO . 10.7 p-90 -83.18 -15.93 48.61 Favored 'General case' 0 CA--C 1.497 -1.081 0 CA-C-N 114.836 -1.074 . . . . 0.0 111.2 178.622 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.662 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 29.1 t-105 -61.61 -44.81 92.86 Favored Pre-proline 0 N--CA 1.426 -1.657 0 C-N-CA 119.281 -0.968 . . . . 0.0 112.42 -177.159 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.577 ' HD3' ' O ' ' A' ' 5' ' ' PRO . 80.7 Cg_exo -43.17 -44.66 9.83 Favored 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 122.308 2.005 . . . . 0.0 112.459 -178.606 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -59.93 -37.74 80.35 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 179.134 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.662 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 6.9 mt -63.34 -68.58 0.33 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 114.951 -1.022 . . . . 0.0 111.513 -179.79 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 12.1 tpt180 -86.12 -59.0 2.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.79 -0.641 . . . . 0.0 112.028 -178.735 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 37.0 mmt180 -71.47 51.07 0.18 Allowed 'General case' 0 C--O 1.249 1.049 0 CA-C-O 118.083 -0.96 . . . . 0.0 111.424 -179.209 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.376 1 O-C-N 110.765 -7.459 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 7.5 p . . . . . 0 N--CA 1.485 1.303 0 CA-C-O 120.8 0.333 . . . . 0.0 111.136 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.42 HH11 ' HG2' ' A' ' 2' ' ' ARG . 11.8 tpt180 -170.76 -46.72 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.872 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.425 ' HG3' ' O ' ' A' ' 3' ' ' ARG . 10.5 tpt180 -87.67 35.47 0.73 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.714 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.938 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -71.65 -168.23 0.08 OUTLIER Pre-proline 0 CA--C 1.54 0.576 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.339 179.938 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.938 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 97.9 Cg_exo -48.23 156.1 1.73 Allowed 'Trans proline' 0 C--N 1.364 1.349 0 C-N-CA 122.669 2.246 . . . . 0.0 113.328 -179.649 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 38.6 p-90 -63.55 -31.59 72.8 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 177.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.644 ' CE3' HD11 ' A' ' 11' ' ' LEU . 11.5 p-90 -85.61 -18.0 34.57 Favored 'General case' 0 CA--C 1.499 -0.989 0 CA-C-N 115.088 -0.96 . . . . 0.0 111.75 179.086 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.656 ' N ' ' HD2' ' A' ' 9' ' ' PRO . 25.6 t-105 -59.8 -44.27 96.79 Favored Pre-proline 0 N--CA 1.428 -1.532 0 C-N-CA 119.349 -0.94 . . . . 0.0 113.156 -176.598 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.656 ' HD2' ' N ' ' A' ' 8' ' ' TRP . 1.8 Cg_endo -46.96 -43.91 23.65 Favored 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 121.934 1.756 . . . . 0.0 112.34 -178.41 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -58.7 -35.1 72.1 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 178.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.644 HD11 ' CE3' ' A' ' 7' ' ' TRP . 9.1 mt -65.45 -70.07 0.26 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 114.793 -1.094 . . . . 0.0 111.551 -179.694 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 78.3 ttt180 -86.75 -56.2 3.51 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.953 -0.567 . . . . 0.0 112.006 -179.074 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 37.5 mmt180 -70.09 17.05 0.06 Allowed 'General case' 0 C--O 1.25 1.093 0 CA-C-O 118.076 -0.964 . . . . 0.0 111.499 -179.182 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.365 0 O-C-N 120.841 -1.162 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . 0.45 HG12 ' O ' ' A' ' 1' ' ' VAL . 18.1 t . . . . . 0 N--CA 1.485 1.298 0 CA-C-O 121.235 0.541 . . . . 0.0 110.741 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 78.4 ttt180 -67.33 145.99 54.55 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.965 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 78.5 ttt180 -168.21 -46.26 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.218 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.936 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -68.06 -170.03 0.08 OUTLIER Pre-proline 0 CA--C 1.541 0.626 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.874 179.902 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.936 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 88.7 Cg_exo -50.74 159.66 2.19 Favored 'Trans proline' 0 C--N 1.361 1.211 0 C-N-CA 123.095 2.53 . . . . 0.0 113.721 -179.466 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 45.8 p-90 -66.93 -31.4 71.96 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 177.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.642 ' CE3' HD11 ' A' ' 11' ' ' LEU . 10.6 p-90 -85.67 -17.37 36.24 Favored 'General case' 0 CA--C 1.496 -1.1 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.468 179.059 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.681 ' N ' ' HD2' ' A' ' 9' ' ' PRO . 25.2 t-105 -60.2 -43.9 94.89 Favored Pre-proline 0 N--CA 1.424 -1.735 0 C-N-CA 119.11 -1.036 . . . . 0.0 113.048 -176.871 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.681 ' HD2' ' N ' ' A' ' 8' ' ' TRP . 1.8 Cg_endo -46.09 -43.13 20.83 Favored 'Trans proline' 0 N--CA 1.459 -0.51 0 C-N-CA 122.169 1.913 . . . . 0.0 112.625 -178.355 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 -61.66 -33.72 74.46 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.424 0.63 . . . . 0.0 109.31 179.162 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.681 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 12.8 mt -61.56 -48.19 82.11 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 114.929 -1.032 . . . . 0.0 112.188 -179.383 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 56.6 ttp85 -127.88 -48.17 1.37 Allowed 'General case' 0 C--O 1.231 0.126 0 N-CA-C 111.976 0.362 . . . . 0.0 111.976 -178.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.589 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 29.7 tpt180 -67.43 17.89 0.03 OUTLIER 'General case' 0 C--O 1.249 1.045 0 CA-C-O 118.081 -0.962 . . . . 0.0 111.377 -179.686 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.33 1 O-C-N 95.13 -17.231 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 8.7 p . . . . . 0 N--CA 1.485 1.303 0 CA-C-O 120.837 0.351 . . . . 0.0 111.034 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 59.4 mtt85 -58.26 128.62 38.08 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.872 -179.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 45.5 mmm-85 -109.37 137.28 47.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.763 179.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.883 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -157.17 -163.81 0.08 OUTLIER Pre-proline 0 CA--C 1.541 0.622 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.083 -179.68 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.883 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 96.4 Cg_exo -48.03 158.15 0.95 Allowed 'Trans proline' 0 C--N 1.367 1.51 0 C-N-CA 122.527 2.151 . . . . 0.0 113.092 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.474 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 39.3 p-90 -65.07 -33.38 75.9 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 177.641 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.668 ' CE3' HD11 ' A' ' 11' ' ' LEU . 12.1 p-90 -83.44 -15.82 48.15 Favored 'General case' 0 CA--C 1.497 -1.067 0 CA-C-N 115.117 -0.947 . . . . 0.0 111.541 178.93 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.623 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 32.9 t-105 -60.63 -44.74 96.28 Favored Pre-proline 0 N--CA 1.426 -1.656 0 C-N-CA 119.284 -0.967 . . . . 0.0 112.446 -177.105 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.835 ' HA ' ' HB3' ' A' ' 13' ' ' ARG . 84.3 Cg_exo -43.66 -47.53 9.51 Favored 'Trans proline' 0 N--CA 1.458 -0.562 0 C-N-CA 122.103 1.869 . . . . 0.0 112.621 -178.859 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -56.77 -35.48 68.73 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.443 0.639 . . . . 0.0 109.517 179.262 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.668 HD11 ' CE3' ' A' ' 7' ' ' TRP . 10.1 mt -62.21 -43.83 97.95 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 114.882 -1.054 . . . . 0.0 111.874 -179.312 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 74.5 mtp180 -141.77 -48.91 0.38 Allowed 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -178.825 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.835 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 0.0 OUTLIER -68.66 23.55 0.03 OUTLIER 'General case' 0 C--O 1.249 1.04 0 CA-C-O 118.034 -0.984 . . . . 0.0 110.637 -179.694 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.314 1 O-C-N 90.937 -19.852 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 35.9 m . . . . . 0 N--CA 1.487 1.376 0 CA-C-O 120.756 0.312 . . . . 0.0 111.212 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.505 ' HB2' ' CE2' ' A' ' 4' ' ' TYR . 98.9 mtt180 -58.65 151.18 21.38 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.148 -179.775 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.539 ' HD2' ' N ' ' A' ' 3' ' ' ARG . 7.1 mpt_? -87.17 43.74 1.12 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.429 -179.52 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.911 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -64.34 -167.6 0.03 OUTLIER Pre-proline 0 CA--C 1.542 0.655 0 C-N-CA 120.952 -0.299 . . . . 0.0 111.391 -179.952 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.911 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 81.0 Cg_exo -48.9 158.14 1.36 Allowed 'Trans proline' 0 C--N 1.365 1.399 0 C-N-CA 122.635 2.223 . . . . 0.0 113.342 -179.794 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.449 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 39.4 p-90 -65.48 -33.68 76.5 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 177.564 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.69 ' CE3' HD11 ' A' ' 11' ' ' LEU . 9.9 p-90 -81.93 -17.69 46.23 Favored 'General case' 0 CA--C 1.497 -1.09 0 CA-C-N 115.078 -0.964 . . . . 0.0 111.178 178.557 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.651 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 35.4 t-105 -57.41 -46.49 99.8 Favored Pre-proline 0 N--CA 1.428 -1.546 0 C-N-CA 119.518 -0.873 . . . . 0.0 112.781 -176.948 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.897 ' HA ' ' HB3' ' A' ' 13' ' ' ARG . 89.2 Cg_exo -41.31 -49.63 4.79 Favored 'Trans proline' 0 N--CA 1.458 -0.58 0 C-N-CA 122.266 1.977 . . . . 0.0 112.979 -178.546 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -57.68 -35.75 71.0 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.344 0.592 . . . . 0.0 109.695 179.662 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.69 HD11 ' CE3' ' A' ' 7' ' ' TRP . 10.1 mt -59.68 -41.53 90.87 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.829 -179.538 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 72.4 mtt-85 -146.16 -48.12 0.2 Allowed 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 112.381 0.512 . . . . 0.0 112.381 -178.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.897 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 30.7 tpt180 -66.29 17.65 0.02 OUTLIER 'General case' 0 C--O 1.249 1.06 0 CA-C-O 118.039 -0.981 . . . . 0.0 110.927 -179.623 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.294 1 O-C-N 89.022 -21.049 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 8.6 p . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.708 0.29 . . . . 0.0 111.122 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 37.7 ptt180 -60.39 139.5 57.65 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.278 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 9.8 ptp180 -167.4 42.82 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.86 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.926 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -143.58 -166.28 0.12 Allowed Pre-proline 0 CA--C 1.541 0.598 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.313 179.843 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.926 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 90.9 Cg_exo -48.78 162.77 0.34 Allowed 'Trans proline' 0 C--N 1.365 1.396 0 C-N-CA 122.731 2.287 . . . . 0.0 113.429 -179.74 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.484 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 33.3 p-90 -69.31 -33.44 73.16 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 177.542 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.638 ' CH2' ' HG2' ' A' ' 5' ' ' PRO . 11.3 p-90 -83.65 -16.0 46.75 Favored 'General case' 0 CA--C 1.498 -1.04 0 CA-C-N 114.945 -1.025 . . . . 0.0 111.359 178.777 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.652 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 29.1 t-105 -61.32 -44.18 92.17 Favored Pre-proline 0 N--CA 1.426 -1.645 0 C-N-CA 119.336 -0.945 . . . . 0.0 112.611 -177.016 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.599 ' HD3' ' O ' ' A' ' 5' ' ' PRO . 86.2 Cg_exo -43.46 -49.4 7.66 Favored 'Trans proline' 0 N--CA 1.46 -0.491 0 C-N-CA 122.174 1.916 . . . . 0.0 112.541 -178.649 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 7.4 m-85 -56.16 -35.35 67.09 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 179.208 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.652 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 6.8 mt -65.93 -70.58 0.23 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.09 -0.959 . . . . 0.0 111.51 -179.795 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.591 ' HA ' ' HE ' ' A' ' 12' ' ' ARG . 5.3 tpm_? -83.08 -57.51 3.25 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.987 -178.809 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 29.0 tpt180 -63.22 -3.43 1.85 Allowed 'General case' 0 C--O 1.249 1.062 0 CA-C-O 118.297 -0.859 . . . . 0.0 111.029 -179.386 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.311 1 O-C-N 82.269 -25.27 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . 0.416 ' H3 ' ' NH2' ' A' ' 13' ' ' ARG . 12.2 p . . . . . 0 N--CA 1.485 1.299 0 CA-C-O 120.853 0.358 . . . . 0.0 111.099 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 57.6 ttp85 -68.7 134.1 49.36 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.45 179.629 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 9.6 ptp180 -169.1 43.25 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.924 0.392 . . . . 0.0 111.287 -179.733 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.925 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -149.44 -163.75 0.07 OUTLIER Pre-proline 0 CA--C 1.541 0.612 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.884 179.542 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.925 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 94.0 Cg_exo -48.01 155.8 1.66 Allowed 'Trans proline' 0 C--N 1.367 1.527 0 C-N-CA 122.377 2.051 . . . . 0.0 113.067 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.438 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 31.0 p-90 -63.46 -33.8 76.37 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 177.53 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.708 ' CE3' HD11 ' A' ' 11' ' ' LEU . 9.7 p-90 -81.39 -16.78 51.15 Favored 'General case' 0 CA--C 1.499 -0.981 0 CA-C-N 114.986 -1.006 . . . . 0.0 111.278 178.618 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.641 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 37.6 t-105 -59.18 -47.25 98.75 Favored Pre-proline 0 N--CA 1.431 -1.378 0 C-N-CA 119.358 -0.937 . . . . 0.0 112.911 -176.822 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.499 ' HD3' ' O ' ' A' ' 5' ' ' PRO . 83.4 Cg_exo -41.33 -44.29 5.71 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.445 2.097 . . . . 0.0 112.704 -178.54 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -61.49 -37.39 83.48 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 179.38 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.708 HD11 ' CE3' ' A' ' 7' ' ' TRP . 8.0 mt -63.54 -68.55 0.34 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 114.976 -1.011 . . . . 0.0 112.052 -179.415 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.553 ' HA ' ' HE ' ' A' ' 12' ' ' ARG . 5.4 tpm_? -91.13 -55.55 3.49 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.028 -0.533 . . . . 0.0 112.362 -178.163 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.416 ' NH2' ' H3 ' ' A' ' 1' ' ' VAL . 36.5 mmt180 -70.64 24.16 0.04 OUTLIER 'General case' 0 C--O 1.248 1.022 0 CA-C-O 118.063 -0.97 . . . . 0.0 111.483 -179.213 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.358 0 CA-C-N 119.422 1.01 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 7.5 p . . . . . 0 N--CA 1.485 1.324 0 CA-C-O 120.85 0.357 . . . . 0.0 111.217 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 55.1 ttp180 -167.89 -33.88 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.172 179.749 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.463 ' HD3' ' C ' ' A' ' 3' ' ' ARG . 4.1 tmt_? -51.34 130.22 26.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.67 0.271 . . . . 0.0 110.351 -179.977 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.936 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -140.51 -168.66 0.19 Allowed Pre-proline 0 CA--C 1.541 0.631 0 N-CA-C 112.016 0.376 . . . . 0.0 112.016 -179.626 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.936 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 87.9 Cg_exo -50.56 163.12 0.75 Allowed 'Trans proline' 0 C--N 1.364 1.383 0 C-N-CA 123.13 2.553 . . . . 0.0 113.83 -179.478 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.452 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 33.0 p-90 -69.89 -34.49 73.62 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 177.33 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.64 ' CE3' HD11 ' A' ' 11' ' ' LEU . 10.1 p-90 -81.59 -17.51 48.02 Favored 'General case' 0 CA--C 1.496 -1.117 0 CA-C-N 114.976 -1.011 . . . . 0.0 111.11 178.591 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.621 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 42.8 t-105 -58.44 -46.25 99.63 Favored Pre-proline 0 N--CA 1.425 -1.712 0 C-N-CA 119.215 -0.994 . . . . 0.0 112.552 -177.113 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.826 ' HA ' ' HB3' ' A' ' 13' ' ' ARG . 74.3 Cg_exo -40.54 -50.81 3.69 Favored 'Trans proline' 0 N--CA 1.456 -0.684 0 C-N-CA 122.317 2.012 . . . . 0.0 112.766 -178.467 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -55.09 -37.11 66.38 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.38 0.609 . . . . 0.0 109.373 179.445 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.64 HD11 ' CE3' ' A' ' 7' ' ' TRP . 7.1 mt -62.88 -40.54 97.84 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.067 -0.97 . . . . 0.0 111.225 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 43.3 ttt85 -150.48 -51.59 0.14 Allowed 'General case' 0 CA--C 1.53 0.173 0 N-CA-C 112.002 0.371 . . . . 0.0 112.002 -179.016 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.826 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 12.1 tpt180 -73.34 47.6 0.22 Allowed 'General case' 0 C--O 1.249 1.044 0 CA-C-O 118.06 -0.972 . . . . 0.0 111.179 -179.723 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.311 1 O-C-N 85.524 -23.235 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 55.4 t . . . . . 0 N--CA 1.485 1.283 0 CA-C-O 120.784 0.326 . . . . 0.0 111.045 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 40.0 ttm180 -170.23 -40.17 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.126 179.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 25.6 mtm105 -46.88 138.25 6.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.882 0.372 . . . . 0.0 111.577 -179.386 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.895 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -146.19 -165.38 0.1 Allowed Pre-proline 0 CA--C 1.542 0.664 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.004 179.706 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.895 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 82.4 Cg_exo -49.11 157.23 1.89 Allowed 'Trans proline' 0 C--N 1.366 1.489 0 C-N-CA 122.544 2.162 . . . . 0.0 113.316 -179.801 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.449 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 35.2 p-90 -64.44 -33.97 77.1 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 177.54 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.689 ' CE3' HD11 ' A' ' 11' ' ' LEU . 9.8 p-90 -81.68 -16.21 52.02 Favored 'General case' 0 CA--C 1.499 -1.011 0 CA-C-N 115.05 -0.977 . . . . 0.0 111.146 178.565 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.637 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 33.9 t-105 -59.4 -47.03 98.87 Favored Pre-proline 0 N--CA 1.429 -1.509 0 C-N-CA 119.377 -0.929 . . . . 0.0 113.06 -176.889 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.572 ' HA ' ' HB3' ' A' ' 13' ' ' ARG . 72.3 Cg_exo -41.86 -46.02 6.75 Favored 'Trans proline' 0 N--CA 1.458 -0.572 0 C-N-CA 122.224 1.949 . . . . 0.0 112.693 -178.463 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -59.4 -37.15 77.27 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.344 0.593 . . . . 0.0 109.788 179.616 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.689 HD11 ' CE3' ' A' ' 7' ' ' TRP . 10.9 mt -58.76 -42.88 89.94 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.065 -0.97 . . . . 0.0 112.253 -179.095 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.451 ' HG2' HH11 ' A' ' 12' ' ' ARG . 65.5 mtt-85 -136.51 -49.3 0.65 Allowed 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 112.474 0.546 . . . . 0.0 112.474 -178.665 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.572 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 29.6 tpt180 -64.84 6.94 0.19 Allowed 'General case' 0 C--O 1.249 1.031 0 CA-C-O 118.333 -0.841 . . . . 0.0 110.933 -179.688 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.325 1 O-C-N 87.761 -21.837 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 27.7 m . . . . . 0 N--CA 1.486 1.327 0 CA-C-O 120.817 0.342 . . . . 0.0 111.282 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 60.8 mtt85 -52.11 131.74 32.36 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.528 179.797 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 27.1 ttt85 -173.95 45.93 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.967 0.413 . . . . 0.0 110.757 -179.379 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.936 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -161.4 -169.17 0.22 Allowed Pre-proline 0 CA--C 1.54 0.591 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -179.769 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.936 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 87.7 Cg_exo -49.23 159.37 1.15 Allowed 'Trans proline' 0 C--N 1.363 1.325 0 C-N-CA 123.194 2.596 . . . . 0.0 113.863 -179.212 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 34.2 p-90 -66.31 -32.35 73.7 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 177.531 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.672 ' CE3' HD11 ' A' ' 11' ' ' LEU . 11.0 p-90 -85.03 -17.3 37.94 Favored 'General case' 0 CA--C 1.499 -1.009 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.322 178.881 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.658 ' N ' ' HD2' ' A' ' 9' ' ' PRO . 25.4 t-105 -60.13 -44.82 97.4 Favored Pre-proline 0 N--CA 1.427 -1.591 0 C-N-CA 119.364 -0.934 . . . . 0.0 113.135 -176.713 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.658 ' HD2' ' N ' ' A' ' 8' ' ' TRP . 1.2 Cg_endo -45.71 -43.02 19.15 Favored 'Trans proline' 0 C--N 1.349 0.565 0 C-N-CA 121.981 1.788 . . . . 0.0 112.483 -178.453 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.4 ' H ' ' HD1' ' A' ' 10' ' ' TYR . 6.4 m-85 -57.64 -36.4 71.8 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 178.801 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.672 HD11 ' CE3' ' A' ' 7' ' ' TRP . 5.4 mt -67.08 -66.19 0.59 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 114.702 -1.136 . . . . 0.0 111.469 -179.707 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 30.4 tpt180 -87.91 -57.26 3.0 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 115.936 -0.574 . . . . 0.0 112.238 -178.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 27.8 mmm180 -62.59 -6.12 3.22 Favored 'General case' 0 C--O 1.25 1.086 0 CA-C-O 118.094 -0.955 . . . . 0.0 111.218 -179.339 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 119.662 1.119 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 47.5 t . . . . . 0 N--CA 1.485 1.31 0 CA-C-O 120.735 0.303 . . . . 0.0 110.989 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.492 ' HG2' HH11 ' A' ' 2' ' ' ARG . 62.2 mtt-85 -78.57 40.47 0.37 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.294 -179.917 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 29.1 tpt180 -66.4 136.26 55.49 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.497 -0.319 . . . . 0.0 110.609 179.567 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.888 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -143.84 -168.56 0.19 Allowed Pre-proline 0 CA--C 1.539 0.521 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.615 179.885 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.888 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 83.6 Cg_exo -49.8 162.88 0.59 Allowed 'Trans proline' 0 C--N 1.362 1.245 0 C-N-CA 122.939 2.426 . . . . 0.0 113.471 -179.562 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.475 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 41.5 p-90 -70.05 -32.78 71.05 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 177.413 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.66 ' CE3' HD11 ' A' ' 11' ' ' LEU . 10.8 p-90 -83.77 -16.71 43.72 Favored 'General case' 0 CA--C 1.497 -1.095 0 CA-C-N 114.917 -1.038 . . . . 0.0 111.369 178.842 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.66 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 33.6 t-105 -60.74 -44.54 95.45 Favored Pre-proline 0 N--CA 1.423 -1.798 0 C-N-CA 119.261 -0.976 . . . . 0.0 112.463 -177.114 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.58 ' HD3' ' O ' ' A' ' 5' ' ' PRO . 80.4 Cg_exo -43.03 -44.83 9.46 Favored 'Trans proline' 0 N--CA 1.46 -0.457 0 C-N-CA 122.268 1.979 . . . . 0.0 112.767 -178.565 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -60.94 -35.57 77.07 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.499 0.666 . . . . 0.0 109.501 179.361 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.66 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 9.8 mt -61.87 -53.04 61.3 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 114.858 -1.065 . . . . 0.0 112.235 -179.211 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 47.5 ttm-85 -117.29 -49.46 2.58 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 112.323 0.49 . . . . 0.0 112.323 -178.353 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.442 ' C ' ' HD2' ' A' ' 13' ' ' ARG . 4.5 tmm_? -62.56 -5.8 2.92 Favored 'General case' 0 C--O 1.249 1.052 0 CA-C-O 118.04 -0.981 . . . . 0.0 110.916 -179.29 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.309 1 O-C-N 86.157 -22.839 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 7.2 p . . . . . 0 N--CA 1.485 1.318 0 CA-C-O 120.882 0.373 . . . . 0.0 111.145 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.536 ' HB3' ' CE2' ' A' ' 4' ' ' TYR . 51.4 ttt-85 -71.1 153.32 42.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.672 -179.95 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 21.2 tpp180 -88.33 47.86 1.56 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.235 -179.618 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.899 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -68.28 -166.95 0.04 OUTLIER Pre-proline 0 CA--C 1.542 0.67 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.298 179.873 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.899 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 85.4 Cg_exo -48.8 161.52 0.48 Allowed 'Trans proline' 0 C--N 1.367 1.533 0 C-N-CA 122.723 2.282 . . . . 0.0 113.431 -179.931 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.471 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 38.4 p-90 -68.22 -33.52 74.56 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 177.457 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.669 ' CE3' HD11 ' A' ' 11' ' ' LEU . 9.2 p-90 -82.32 -17.38 45.95 Favored 'General case' 0 CA--C 1.497 -1.092 0 CA-C-N 114.94 -1.027 . . . . 0.0 111.119 178.724 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.641 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 33.4 t-105 -58.66 -46.26 99.59 Favored Pre-proline 0 N--CA 1.427 -1.577 0 C-N-CA 119.405 -0.918 . . . . 0.0 112.408 -177.236 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.537 ' HD3' ' O ' ' A' ' 5' ' ' PRO . 81.5 Cg_exo -41.16 -46.85 5.34 Favored 'Trans proline' 0 N--CA 1.459 -0.521 0 C-N-CA 122.439 2.093 . . . . 0.0 112.661 -178.921 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.408 ' HD1' ' O ' ' A' ' 7' ' ' TRP . 7.1 m-85 -58.9 -37.15 75.97 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 179.311 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.669 HD11 ' CE3' ' A' ' 7' ' ' TRP . 5.9 mt -65.3 -70.28 0.24 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.749 -179.572 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 29.7 tpt180 -87.11 -56.23 3.47 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.921 -0.582 . . . . 0.0 112.184 -178.466 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.473 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 30.1 tpt180 -64.89 3.81 0.51 Allowed 'General case' 0 C--O 1.249 1.05 0 CA-C-O 118.005 -0.998 . . . . 0.0 111.168 -179.547 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.324 1 O-C-N 88.925 -21.109 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . 0.442 HG23 ' N ' ' A' ' 2' ' ' ARG . 23.0 m . . . . . 0 N--CA 1.485 1.29 0 CA-C-O 120.647 0.26 . . . . 0.0 111.307 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.442 ' N ' HG23 ' A' ' 1' ' ' VAL . 14.5 ptp180 -175.52 51.71 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.956 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.438 ' HG2' HH11 ' A' ' 3' ' ' ARG . 14.9 tpp85 -50.78 -42.18 57.68 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.902 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.927 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -63.07 -169.62 0.04 OUTLIER Pre-proline 0 CA--C 1.541 0.607 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.773 179.946 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.927 ' HD2' ' HB2' ' A' ' 4' ' ' TYR . 80.8 Cg_exo -50.21 164.45 0.47 Allowed 'Trans proline' 0 C--N 1.362 1.275 0 C-N-CA 123.041 2.494 . . . . 0.0 113.58 -179.56 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.479 ' O ' ' HD2' ' A' ' 9' ' ' PRO . 34.1 p-90 -71.14 -33.49 70.12 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 177.392 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.652 ' CH2' ' HG2' ' A' ' 5' ' ' PRO . 10.6 p-90 -83.28 -17.22 43.36 Favored 'General case' 0 CA--C 1.496 -1.112 0 CA-C-N 114.937 -1.029 . . . . 0.0 111.374 178.866 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.664 ' HA ' ' HG ' ' A' ' 11' ' ' LEU . 29.8 t-105 -60.9 -44.31 94.35 Favored Pre-proline 0 N--CA 1.424 -1.748 0 C-N-CA 119.162 -1.015 . . . . 0.0 112.471 -176.993 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.833 ' HA ' ' HB3' ' A' ' 13' ' ' ARG . 81.3 Cg_exo -42.95 -47.53 8.21 Favored 'Trans proline' 0 N--CA 1.459 -0.516 0 C-N-CA 122.108 1.872 . . . . 0.0 112.687 -178.488 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -57.62 -36.52 71.91 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.444 0.64 . . . . 0.0 109.303 179.201 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.664 ' HG ' ' HA ' ' A' ' 8' ' ' TRP . 9.3 mt -61.35 -39.11 89.38 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 114.892 -1.049 . . . . 0.0 111.603 -179.805 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 36.5 ttm180 -150.61 -50.86 0.13 Allowed 'General case' 0 CA--C 1.529 0.164 0 N-CA-C 112.103 0.408 . . . . 0.0 112.103 -178.79 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.833 ' HB3' ' HA ' ' A' ' 9' ' ' PRO . 5.9 tpm_? -72.09 44.74 0.11 Allowed 'General case' 0 C--O 1.249 1.034 0 CA-C-O 118.108 -0.949 . . . . 0.0 111.276 -179.555 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.34 1 O-C-N 85.565 -23.21 . . . . 0.0 . . . . . . . . . . 1 1 . 1 stop_ save_