data_1m02_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 1m02 _Structure_validation_residue.Date_analyzed 2016-10-06 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 . . . . . 0 N--CA 1.487 1.387 0 CA-C-O 120.736 0.303 . . . . 0.0 111.209 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -52.66 130.46 36.99 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 122.527 2.151 . . . . 0.0 112.259 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.464 ' CD1' ' C ' ' A' ' 3' ' ' LEU . 1.2 pp -131.52 13.09 4.98 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.654 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -113.63 -16.83 12.28 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.353 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 -80.66 -24.81 38.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.098 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.6 m-30 58.62 88.8 0.06 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.839 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -80.85 171.55 14.86 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.904 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.455 ' CE3' ' C ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -132.36 -99.74 0.28 Allowed 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 179.99 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.509 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 37.3 mmt180 -64.84 -51.02 60.22 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 120.426 0.155 . . . . 0.0 111.3 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.509 ' HD2' ' N ' ' A' ' 9' ' ' ARG . 59.7 Cg_endo . . . . . 0 C--N 1.348 0.534 0 C-N-CA 122.221 1.947 . . . . 0.0 112.242 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.2 m-70 . . . . . 0 N--CA 1.488 1.466 0 CA-C-O 120.787 0.327 . . . . 0.0 111.255 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -70.12 97.8 0.69 Allowed 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.588 2.192 . . . . 0.0 112.291 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.46 ' CD1' ' C ' ' A' ' 3' ' ' LEU . 1.2 pp -73.75 -11.49 60.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.598 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.406 ' N ' HD11 ' A' ' 3' ' ' LEU . 87.4 tttt -96.1 -19.39 19.45 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.75 0.31 . . . . 0.0 111.32 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -67.14 -23.12 65.76 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.063 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.6 m-30 60.15 74.58 0.44 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.781 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -60.59 177.01 0.32 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.927 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.452 ' CE3' ' C ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -137.85 -95.52 0.2 Allowed 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 179.841 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.478 ' HB2' ' HD3' ' A' ' 10' ' ' PRO . 37.3 mmt180 -58.13 -48.86 96.3 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.857 -0.156 . . . . 0.0 111.255 179.792 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.478 ' HD3' ' HB2' ' A' ' 9' ' ' ARG . 91.2 Cg_endo . . . . . 0 C--N 1.348 0.52 0 C-N-CA 122.302 2.001 . . . . 0.0 112.343 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.672 0.272 . . . . 0.0 111.219 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.43 73.58 1.21 Allowed 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.615 2.21 . . . . 0.0 112.333 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.469 ' CD1' ' C ' ' A' ' 3' ' ' LEU . 1.2 pp -104.3 11.37 34.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.582 -179.952 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -93.9 -18.91 21.46 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.743 0.306 . . . . 0.0 111.168 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -107.24 -12.35 15.39 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.282 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 63.93 88.25 0.1 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.879 0.371 . . . . 0.0 110.872 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -65.6 -176.35 0.34 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.926 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.464 ' CZ2' ' CZ ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -175.88 -95.67 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.503 -0.555 . . . . 0.0 109.503 179.904 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.472 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 37.4 mmt180 -73.13 -49.65 7.04 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 116.925 -0.125 . . . . 0.0 111.303 179.657 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.472 ' HD2' ' N ' ' A' ' 9' ' ' ARG . 72.9 Cg_endo . . . . . 0 C--N 1.348 0.533 0 C-N-CA 122.122 1.881 . . . . 0.0 112.65 -179.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 . . . . . 0 N--CA 1.486 1.335 0 CA-C-O 120.763 0.316 . . . . 0.0 111.237 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -71.17 115.38 4.25 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.62 2.213 . . . . 0.0 112.237 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.455 ' CD1' ' C ' ' A' ' 3' ' ' LEU . 1.2 pp -94.7 12.76 26.65 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.573 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -111.69 -17.87 12.89 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.69 0.281 . . . . 0.0 111.29 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -68.75 -27.71 66.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.935 0.397 . . . . 0.0 111.081 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.6 m-30 57.09 63.65 1.85 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.889 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -61.47 154.81 23.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.968 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.458 ' CE3' ' C ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -149.69 -97.16 0.07 Allowed 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.681 179.967 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.498 ' HB2' ' HD3' ' A' ' 10' ' ' PRO . 37.3 mmt180 -57.31 -47.67 98.63 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 120.379 0.133 . . . . 0.0 111.261 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.498 ' HD3' ' HB2' ' A' ' 9' ' ' ARG . 91.1 Cg_endo . . . . . 0 C--N 1.347 0.493 0 C-N-CA 122.414 2.076 . . . . 0.0 112.109 179.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 . . . . . 0 N--CA 1.488 1.452 0 CA-C-O 120.655 0.264 . . . . 0.0 111.173 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -67.78 113.09 2.86 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.473 2.115 . . . . 0.0 112.247 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.457 ' CD1' ' C ' ' A' ' 3' ' ' LEU . 1.2 pp -103.65 15.61 28.42 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.712 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -87.37 -18.61 29.64 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.789 0.328 . . . . 0.0 111.186 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 -84.63 -21.51 30.27 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.176 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 60.87 84.92 0.12 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.851 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -81.8 174.97 10.82 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.931 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.449 ' CE3' ' C ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -176.95 -94.41 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.935 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.508 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 37.2 mmt180 -69.18 -50.0 22.26 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 116.728 -0.214 . . . . 0.0 111.455 179.868 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.508 ' HD2' ' N ' ' A' ' 9' ' ' ARG . 60.4 Cg_endo . . . . . 0 C--N 1.349 0.569 0 C-N-CA 122.156 1.904 . . . . 0.0 112.639 -179.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 120.735 0.302 . . . . 0.0 111.249 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -68.47 161.91 42.97 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.537 2.158 . . . . 0.0 112.245 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.454 ' CD1' ' C ' ' A' ' 3' ' ' LEU . 1.2 pp -141.13 15.78 2.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.71 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -109.84 -18.16 13.48 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.269 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -78.51 -19.39 53.09 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.13 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.5 m-30 61.93 80.5 0.22 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.85 0.357 . . . . 0.0 110.822 -179.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -61.21 175.29 0.56 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.074 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.444 ' CE3' ' C ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -176.92 -94.51 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 179.934 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.509 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 37.3 mmt180 -66.85 -50.55 43.08 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 116.724 -0.217 . . . . 0.0 111.447 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.509 ' HD2' ' N ' ' A' ' 9' ' ' ARG . 59.2 Cg_endo . . . . . 0 C--N 1.347 0.47 0 C-N-CA 122.161 1.907 . . . . 0.0 112.636 -179.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 . . . . . 0 N--CA 1.487 1.386 0 CA-C-O 120.708 0.29 . . . . 0.0 111.179 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_endo -80.79 53.97 5.02 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.652 2.235 . . . . 0.0 112.589 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.463 ' CD1' ' C ' ' A' ' 3' ' ' LEU . 1.2 pp -88.0 -11.05 48.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.564 179.793 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.402 ' N ' HD11 ' A' ' 3' ' ' LEU . 87.4 tttt -112.63 -18.94 12.24 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.175 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -73.19 -20.47 60.88 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.094 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 62.21 83.29 0.16 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.886 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -68.77 -175.59 0.71 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.894 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.465 ' CZ2' ' CZ ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -141.39 -93.05 0.14 Allowed 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 179.927 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.483 ' N ' ' CD ' ' A' ' 10' ' ' PRO . 37.5 mmt180 -78.24 -45.79 2.15 Favored Pre-proline 0 C--N 1.326 -0.414 0 CA-C-N 116.677 -0.238 . . . . 0.0 111.392 179.523 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.483 ' CD ' ' N ' ' A' ' 9' ' ' ARG . 84.5 Cg_endo . . . . . 0 C--N 1.347 0.461 0 C-N-CA 122.458 2.105 . . . . 0.0 112.3 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 89.9 m-70 . . . . . 0 N--CA 1.486 1.356 0 CA-C-O 120.769 0.319 . . . . 0.0 111.135 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -75.27 80.02 2.59 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.525 2.15 . . . . 0.0 112.356 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.456 ' CD1' ' C ' ' A' ' 3' ' ' LEU . 1.2 pp -95.56 -12.03 26.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.552 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -97.09 78.2 2.76 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.785 0.326 . . . . 0.0 110.756 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 179.84 -29.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.316 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 66.98 82.9 0.17 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.831 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -63.56 175.33 1.08 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.008 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.453 ' CZ2' ' CZ ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -139.29 -95.75 0.17 Allowed 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 179.942 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.467 ' HB2' ' HD3' ' A' ' 10' ' ' PRO . 37.3 mmt180 -71.41 -48.99 12.25 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.885 -0.143 . . . . 0.0 111.315 179.704 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.467 ' HD3' ' HB2' ' A' ' 9' ' ' ARG . 79.4 Cg_endo . . . . . 0 C--N 1.349 0.563 0 C-N-CA 122.284 1.989 . . . . 0.0 112.373 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 . . . . . 0 N--CA 1.486 1.335 0 CA-C-O 120.624 0.249 . . . . 0.0 111.156 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . 0.448 ' HG3' ' CD2' ' A' ' 7' ' ' TRP . 46.3 Cg_exo -54.9 144.06 68.98 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.455 2.103 . . . . 0.0 112.262 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.476 ' CD1' ' C ' ' A' ' 3' ' ' LEU . 1.2 pp -133.37 6.48 3.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.817 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt 178.47 -32.03 0.01 OUTLIER 'General case' 0 C--O 1.231 0.099 0 CA-C-O 120.965 0.412 . . . . 0.0 111.288 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 -83.9 -31.41 25.7 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.196 -179.678 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.6 m-30 56.0 74.96 0.36 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.858 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.448 ' CD2' ' HG3' ' A' ' 2' ' ' PRO . 1.8 p90 -83.34 155.48 23.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.944 -179.773 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.456 ' CE3' ' C ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -111.14 -97.23 0.41 Allowed 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 179.954 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.512 ' N ' ' CD ' ' A' ' 10' ' ' PRO . 37.3 mmt180 -58.96 -44.51 98.99 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 120.414 0.15 . . . . 0.0 111.265 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.512 ' CD ' ' N ' ' A' ' 9' ' ' ARG . 37.4 Cg_exo . . . . . 0 C--N 1.348 0.546 0 C-N-CA 122.349 2.033 . . . . 0.0 112.133 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 1' ' ' HIS . . . . . 0.469 ' HB2' ' HD3' ' A' ' 2' ' ' PRO . 90.1 m-70 . . . . . 0 N--CA 1.489 1.482 0 N-CA-C 111.927 0.343 . . . . 0.0 111.927 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . 0.469 ' HD3' ' HB2' ' A' ' 1' ' ' HIS . 97.5 Cg_endo -79.78 81.46 2.76 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 122.17 1.913 . . . . 0.0 112.371 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.458 ' CD1' ' C ' ' A' ' 3' ' ' LEU . 1.2 pp -112.29 15.36 20.4 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.678 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -95.87 -17.8 20.83 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.216 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -103.8 -15.32 15.74 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.247 -179.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 62.54 81.62 0.2 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.86 0.362 . . . . 0.0 110.779 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -59.46 162.99 4.37 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.079 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.455 ' CE3' ' C ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -124.53 -95.58 0.46 Allowed 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 179.84 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.469 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 37.3 mmt180 -62.59 -49.29 83.77 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-N 116.874 -0.148 . . . . 0.0 111.191 179.683 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.469 ' HD2' ' N ' ' A' ' 9' ' ' ARG . 76.3 Cg_endo . . . . . 0 C--N 1.349 0.576 0 C-N-CA 122.238 1.958 . . . . 0.0 112.353 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 1' ' ' HIS . . . . . 0.478 ' HB2' ' HD3' ' A' ' 2' ' ' PRO . 90.0 m-70 . . . . . 0 N--CA 1.49 1.529 0 N-CA-C 111.852 0.315 . . . . 0.0 111.852 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . 0.478 ' HD3' ' HB2' ' A' ' 1' ' ' HIS . 98.7 Cg_endo -79.83 83.31 2.27 Favored 'Trans proline' 0 C--N 1.349 0.565 0 C-N-CA 122.126 1.884 . . . . 0.0 112.364 -179.827 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.465 ' CD1' ' C ' ' A' ' 3' ' ' LEU . 1.2 pp -79.79 -9.66 59.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.613 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -78.56 -18.75 54.2 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.758 0.313 . . . . 0.0 111.182 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -76.49 -19.72 57.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.154 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.5 m-30 62.17 73.63 0.46 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.852 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -74.47 165.28 25.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.881 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.458 ' CE3' ' C ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -159.48 -98.26 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 -179.957 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.474 ' N ' ' CD ' ' A' ' 10' ' ' PRO . 37.3 mmt180 -58.38 -46.57 99.62 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 120.402 0.144 . . . . 0.0 111.281 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.474 ' CD ' ' N ' ' A' ' 9' ' ' ARG . 95.9 Cg_endo . . . . . 0 N--CA 1.459 -0.504 0 C-N-CA 122.495 2.13 . . . . 0.0 112.305 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 . . . . . 0 N--CA 1.487 1.417 0 CA-C-O 120.676 0.274 . . . . 0.0 111.242 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -52.1 125.72 18.15 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.571 2.18 . . . . 0.0 112.25 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.472 ' CD1' ' C ' ' A' ' 3' ' ' LEU . 1.2 pp -125.01 1.57 7.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.717 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -112.48 -18.5 12.41 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.768 0.318 . . . . 0.0 111.278 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 -98.7 -20.29 17.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.098 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.51 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 6.4 m-30 62.61 18.1 10.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.207 179.935 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.51 ' CD1' ' O ' ' A' ' 6' ' ' TYR . 1.9 p90 42.21 -167.13 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.537 179.973 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.465 ' CE3' ' C ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -170.43 -99.51 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 -179.917 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.501 ' N ' ' CD ' ' A' ' 10' ' ' PRO . 37.3 mmt180 -66.14 -44.76 60.83 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 120.385 0.136 . . . . 0.0 111.19 179.819 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.501 ' CD ' ' N ' ' A' ' 9' ' ' ARG . 12.8 Cg_exo . . . . . 0 C--N 1.348 0.52 0 C-N-CA 122.478 2.118 . . . . 0.0 112.257 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 . . . . . 0 N--CA 1.485 1.324 0 CA-C-O 120.779 0.323 . . . . 0.0 111.193 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -71.81 134.62 24.15 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.544 2.163 . . . . 0.0 112.302 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.494 ' CD1' ' C ' ' A' ' 3' ' ' LEU . 1.1 pp -90.19 2.29 55.53 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.625 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -90.41 -16.71 28.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.825 0.345 . . . . 0.0 111.001 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -143.15 106.4 4.56 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.856 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.535 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 7.1 m-30 -86.51 9.72 17.47 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.519 179.775 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.535 ' CD1' ' O ' ' A' ' 6' ' ' TYR . 1.9 p90 44.2 -170.33 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.896 0.379 . . . . 0.0 111.558 179.89 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.458 ' CE3' ' C ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -143.91 -96.7 0.11 Allowed 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 -179.891 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.501 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 37.4 mmt180 -62.75 -50.16 79.08 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-N 116.882 -0.145 . . . . 0.0 111.3 179.833 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.501 ' HD2' ' N ' ' A' ' 9' ' ' ARG . 67.0 Cg_endo . . . . . 0 C--N 1.348 0.533 0 C-N-CA 122.258 1.972 . . . . 0.0 112.296 179.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 . . . . . 0 N--CA 1.486 1.334 0 CA-C-O 120.696 0.284 . . . . 0.0 111.164 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -70.3 103.34 1.24 Allowed 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.577 2.185 . . . . 0.0 112.311 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.451 ' CD1' ' C ' ' A' ' 3' ' ' LEU . 1.2 pp -100.02 16.98 22.2 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.524 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -105.51 -16.77 14.63 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.306 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 -91.81 -20.21 21.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.299 -179.833 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 60.17 75.99 0.38 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.734 -179.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -73.05 -176.17 2.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.974 -179.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.534 ' CH2' ' CZ ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -158.34 -96.61 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 179.745 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.534 ' CZ ' ' CH2' ' A' ' 8' ' ' TRP . 38.1 mmt180 -92.31 -48.59 0.31 Allowed Pre-proline 0 C--N 1.33 -0.242 0 N-CA-C 111.496 0.184 . . . . 0.0 111.496 178.521 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.492 ' HD3' ' HB2' ' A' ' 9' ' ' ARG . 93.4 Cg_endo . . . . . 0 C--N 1.349 0.574 0 C-N-CA 122.436 2.091 . . . . 0.0 112.424 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 . . . . . 0 N--CA 1.487 1.411 0 CA-C-O 120.693 0.282 . . . . 0.0 111.22 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -75.65 97.36 1.1 Allowed 'Trans proline' 0 C--N 1.343 0.264 0 C-N-CA 122.657 2.238 . . . . 0.0 112.36 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.441 ' CD1' ' C ' ' A' ' 3' ' ' LEU . 1.2 pp -116.6 -17.24 10.63 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.818 -179.944 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.43 ' N ' HD11 ' A' ' 3' ' ' LEU . 87.4 tttt -137.09 -14.56 1.55 Allowed 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -179.757 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 -101.69 -30.33 11.39 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.897 0.38 . . . . 0.0 111.114 -179.778 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.518 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 6.6 m-30 55.4 33.13 20.22 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.988 179.98 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.518 ' CD1' ' O ' ' A' ' 6' ' ' TYR . 1.9 p90 43.37 -169.05 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.51 -179.931 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.454 ' CE3' ' C ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -150.3 -95.9 0.07 Allowed 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 -179.903 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.477 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 37.3 mmt180 -71.9 -49.67 10.22 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.879 -0.146 . . . . 0.0 111.202 179.581 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.477 ' HD2' ' N ' ' A' ' 9' ' ' ARG . 71.8 Cg_endo . . . . . 0 C--N 1.348 0.517 0 C-N-CA 122.281 1.988 . . . . 0.0 112.42 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 . . . . . 0 N--CA 1.486 1.367 0 CA-C-O 120.621 0.248 . . . . 0.0 111.201 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_exo -47.74 159.99 0.49 Allowed 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.606 2.204 . . . . 0.0 112.343 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.471 ' CD1' ' C ' ' A' ' 3' ' ' LEU . 1.2 pp -134.3 9.68 3.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.781 -179.926 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -127.7 -13.3 5.34 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 111.742 0.275 . . . . 0.0 111.742 -179.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -70.21 -31.33 68.72 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.91 0.386 . . . . 0.0 111.138 -179.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.9 m-30 54.67 80.52 0.12 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.041 179.91 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -104.27 161.75 13.78 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.665 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.537 ' CH2' ' CZ ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -112.31 -97.84 0.42 Allowed 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 -179.962 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.537 ' CZ ' ' CH2' ' A' ' 8' ' ' TRP . 38.1 mmt180 -88.61 -48.09 0.43 Allowed Pre-proline 0 CA--C 1.532 0.268 0 CA-C-N 116.915 -0.13 . . . . 0.0 111.292 178.709 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.472 ' HD3' ' HB2' ' A' ' 9' ' ' ARG . 91.0 Cg_endo . . . . . 0 C--N 1.349 0.598 0 C-N-CA 122.391 2.061 . . . . 0.0 112.509 -179.718 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 1' ' ' HIS . . . . . 0.476 ' HB2' ' HD3' ' A' ' 2' ' ' PRO . 90.0 m-70 . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 111.947 0.351 . . . . 0.0 111.947 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . 0.476 ' HD3' ' HB2' ' A' ' 1' ' ' HIS . 95.0 Cg_endo -80.46 57.8 6.69 Favored 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 122.182 1.921 . . . . 0.0 112.361 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.462 ' CD1' ' C ' ' A' ' 3' ' ' LEU . 1.2 pp -110.1 12.94 23.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.645 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -76.75 -18.75 58.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.765 0.317 . . . . 0.0 111.137 179.892 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . 0.414 ' O ' ' HG2' ' A' ' 5' ' ' GLN . 41.4 tt0 -112.03 -4.2 14.55 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.269 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 65.52 91.84 0.08 Allowed 'General case' 0 C--O 1.231 0.116 0 CA-C-O 120.838 0.351 . . . . 0.0 110.812 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -65.8 -177.88 0.51 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.01 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.46 ' CE3' ' C ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -171.29 -98.12 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 179.954 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.527 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 37.3 mmt180 -62.88 -55.36 38.77 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 120.354 0.121 . . . . 0.0 111.204 179.828 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.527 ' HD2' ' N ' ' A' ' 9' ' ' ARG . 19.7 Cg_endo . . . . . 0 C--N 1.348 0.543 0 C-N-CA 122.267 1.978 . . . . 0.0 112.346 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 89.9 m-70 . . . . . 0 N--CA 1.486 1.371 0 CA-C-O 120.641 0.258 . . . . 0.0 111.123 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_endo -78.5 56.93 6.07 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.58 2.187 . . . . 0.0 112.43 -179.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.448 ' CD1' ' C ' ' A' ' 3' ' ' LEU . 1.2 pp -113.45 16.45 18.85 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.558 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -74.57 -19.67 60.24 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.11 179.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . 0.421 ' O ' ' HB2' ' A' ' 6' ' ' TYR . 41.5 tt0 -116.89 -4.6 11.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.084 179.862 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.483 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 6.2 m-30 70.32 8.32 6.58 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.503 -179.981 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.483 ' CD1' ' O ' ' A' ' 6' ' ' TYR . 1.9 p90 40.66 -165.0 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.819 0.342 . . . . 0.0 111.611 179.66 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.454 ' CZ2' ' CZ ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -170.5 -95.56 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 -179.991 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.474 ' HB2' ' HD3' ' A' ' 10' ' ' PRO . 37.4 mmt180 -72.84 -49.06 8.05 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 116.849 -0.159 . . . . 0.0 111.173 179.548 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.474 ' HD3' ' HB2' ' A' ' 9' ' ' ARG . 91.3 Cg_endo . . . . . 0 C--N 1.349 0.557 0 C-N-CA 122.223 1.949 . . . . 0.0 112.396 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 . . . . . 0 N--CA 1.485 1.323 0 CA-C-O 120.661 0.267 . . . . 0.0 111.261 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -67.99 124.67 12.08 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.606 2.204 . . . . 0.0 112.237 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.464 ' CD1' ' C ' ' A' ' 3' ' ' LEU . 1.2 pp -74.0 -10.53 59.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.646 -179.949 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -82.5 -17.49 44.93 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.702 0.287 . . . . 0.0 111.273 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 -97.42 93.73 6.64 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.953 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.539 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 6.5 m-30 -71.14 -12.58 61.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.207 179.841 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . 0.539 ' CD1' ' O ' ' A' ' 6' ' ' TYR . 1.9 p90 44.38 -170.69 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 120.998 0.428 . . . . 0.0 111.512 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' TRP . . . . . 0.455 ' CE3' ' C ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -154.99 -94.91 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 -179.841 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.53 ' HB2' ' HD3' ' A' ' 10' ' ' PRO . 37.3 mmt180 -60.0 -47.07 97.92 Favored Pre-proline 0 C--N 1.328 -0.37 0 CA-C-N 116.905 -0.134 . . . . 0.0 111.129 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.53 ' HD3' ' HB2' ' A' ' 9' ' ' ARG . 2.1 Cg_endo . . . . . 0 C--N 1.348 0.514 0 C-N-CA 122.864 2.376 . . . . 0.0 112.039 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 . . . . . 0 N--CA 1.487 1.387 0 CA-C-O 120.736 0.303 . . . . 0.0 111.209 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -52.66 130.46 36.99 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 122.527 2.151 . . . . 0.0 112.259 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.464 ' CD1' ' C ' ' A' ' 3' ' ' LEU . 1.2 pp -131.52 13.09 4.98 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.654 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -113.63 -16.83 12.28 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.353 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 -80.66 -24.81 38.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.098 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.6 m-30 58.62 88.8 0.06 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.839 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -80.85 171.55 14.86 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.904 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.455 ' CE3' ' C ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -132.36 -99.74 0.28 Allowed 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 179.99 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.509 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 37.3 mmt180 -64.84 -51.02 60.22 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 120.426 0.155 . . . . 0.0 111.3 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.509 ' HD2' ' N ' ' A' ' 9' ' ' ARG . 59.7 Cg_endo -72.26 84.71 1.11 Allowed 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 122.221 1.947 . . . . 0.0 112.242 -179.898 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 52.9 m -121.47 121.52 37.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.851 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.8 mm . . . . . 0 C--O 1.251 1.139 0 CA-C-O 118.181 -0.914 . . . . 0.0 110.836 179.994 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.2 m-70 . . . . . 0 N--CA 1.488 1.466 0 CA-C-O 120.787 0.327 . . . . 0.0 111.255 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -70.12 97.8 0.69 Allowed 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.588 2.192 . . . . 0.0 112.291 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.46 ' CD1' ' C ' ' A' ' 3' ' ' LEU . 1.2 pp -73.75 -11.49 60.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.598 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.406 ' N ' HD11 ' A' ' 3' ' ' LEU . 87.4 tttt -96.1 -19.39 19.45 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.75 0.31 . . . . 0.0 111.32 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -67.14 -23.12 65.76 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.063 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.6 m-30 60.15 74.58 0.44 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.781 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -60.59 177.01 0.32 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.927 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.452 ' CE3' ' C ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -137.85 -95.52 0.2 Allowed 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 179.841 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.478 ' HB2' ' HD3' ' A' ' 10' ' ' PRO . 37.3 mmt180 -58.13 -48.86 96.3 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.857 -0.156 . . . . 0.0 111.255 179.792 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.478 ' HD3' ' HB2' ' A' ' 9' ' ' ARG . 91.2 Cg_endo -78.18 76.98 4.14 Favored 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 122.302 2.001 . . . . 0.0 112.343 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 52.4 m -86.54 116.67 24.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.855 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.7 mm . . . . . 0 C--O 1.25 1.086 0 CA-C-O 118.28 -0.867 . . . . 0.0 110.919 179.953 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.672 0.272 . . . . 0.0 111.219 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.43 73.58 1.21 Allowed 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.615 2.21 . . . . 0.0 112.333 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.469 ' CD1' ' C ' ' A' ' 3' ' ' LEU . 1.2 pp -104.3 11.37 34.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.582 -179.952 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -93.9 -18.91 21.46 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.743 0.306 . . . . 0.0 111.168 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -107.24 -12.35 15.39 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.282 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 63.93 88.25 0.1 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.879 0.371 . . . . 0.0 110.872 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -65.6 -176.35 0.34 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.926 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.464 ' CZ2' ' CZ ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -175.88 -95.67 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.503 -0.555 . . . . 0.0 109.503 179.904 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.472 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 37.4 mmt180 -73.13 -49.65 7.04 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 116.925 -0.125 . . . . 0.0 111.303 179.657 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.472 ' HD2' ' N ' ' A' ' 9' ' ' ARG . 72.9 Cg_endo -75.99 -13.25 19.47 Favored 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.122 1.881 . . . . 0.0 112.65 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 52.8 m 62.19 31.11 17.74 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.97 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.7 mm . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.852 179.978 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 . . . . . 0 N--CA 1.486 1.335 0 CA-C-O 120.763 0.316 . . . . 0.0 111.237 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -71.17 115.38 4.25 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.62 2.213 . . . . 0.0 112.237 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.455 ' CD1' ' C ' ' A' ' 3' ' ' LEU . 1.2 pp -94.7 12.76 26.65 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.573 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -111.69 -17.87 12.89 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.69 0.281 . . . . 0.0 111.29 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -68.75 -27.71 66.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.935 0.397 . . . . 0.0 111.081 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.6 m-30 57.09 63.65 1.85 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.889 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -61.47 154.81 23.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.968 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.458 ' CE3' ' C ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -149.69 -97.16 0.07 Allowed 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.681 179.967 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.498 ' HB2' ' HD3' ' A' ' 10' ' ' PRO . 37.3 mmt180 -57.31 -47.67 98.63 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 120.379 0.133 . . . . 0.0 111.261 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.498 ' HD3' ' HB2' ' A' ' 9' ' ' ARG . 91.1 Cg_endo -83.23 -164.17 0.25 Allowed 'Trans proline' 0 C--N 1.347 0.493 0 C-N-CA 122.414 2.076 . . . . 0.0 112.109 179.833 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 52.9 m -164.67 103.82 0.81 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.883 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.8 mm . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.26 -0.876 . . . . 0.0 110.945 179.985 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 . . . . . 0 N--CA 1.488 1.452 0 CA-C-O 120.655 0.264 . . . . 0.0 111.173 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -67.78 113.09 2.86 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.473 2.115 . . . . 0.0 112.247 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.457 ' CD1' ' C ' ' A' ' 3' ' ' LEU . 1.2 pp -103.65 15.61 28.42 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.712 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -87.37 -18.61 29.64 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.789 0.328 . . . . 0.0 111.186 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 -84.63 -21.51 30.27 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.176 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 60.87 84.92 0.12 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.851 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -81.8 174.97 10.82 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.931 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.449 ' CE3' ' C ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -176.95 -94.41 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.935 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.508 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 37.2 mmt180 -69.18 -50.0 22.26 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 116.728 -0.214 . . . . 0.0 111.455 179.868 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.508 ' HD2' ' N ' ' A' ' 9' ' ' ARG . 60.4 Cg_endo -72.56 -23.53 19.81 Favored 'Trans proline' 0 C--N 1.349 0.569 0 C-N-CA 122.156 1.904 . . . . 0.0 112.639 -179.823 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 52.5 m 51.09 28.92 4.26 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.181 179.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.8 mm . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.24 -0.886 . . . . 0.0 110.873 -179.959 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 120.735 0.302 . . . . 0.0 111.249 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -68.47 161.91 42.97 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.537 2.158 . . . . 0.0 112.245 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.454 ' CD1' ' C ' ' A' ' 3' ' ' LEU . 1.2 pp -141.13 15.78 2.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.71 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -109.84 -18.16 13.48 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.269 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -78.51 -19.39 53.09 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.13 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.5 m-30 61.93 80.5 0.22 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.85 0.357 . . . . 0.0 110.822 -179.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -61.21 175.29 0.56 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.074 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.444 ' CE3' ' C ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -176.92 -94.51 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 179.934 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.509 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 37.3 mmt180 -66.85 -50.55 43.08 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 116.724 -0.217 . . . . 0.0 111.447 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.509 ' HD2' ' N ' ' A' ' 9' ' ' ARG . 59.2 Cg_endo -71.88 -26.16 19.15 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.161 1.907 . . . . 0.0 112.636 -179.789 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 53.5 m 50.78 96.72 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.157 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.7 mm . . . . . 0 C--O 1.25 1.091 0 CA-C-O 118.285 -0.864 . . . . 0.0 110.903 179.946 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 . . . . . 0 N--CA 1.487 1.386 0 CA-C-O 120.708 0.29 . . . . 0.0 111.179 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_endo -80.79 53.97 5.02 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.652 2.235 . . . . 0.0 112.589 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.463 ' CD1' ' C ' ' A' ' 3' ' ' LEU . 1.2 pp -88.0 -11.05 48.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.564 179.793 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.402 ' N ' HD11 ' A' ' 3' ' ' LEU . 87.4 tttt -112.63 -18.94 12.24 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.175 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -73.19 -20.47 60.88 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.094 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 62.21 83.29 0.16 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.886 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -68.77 -175.59 0.71 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.894 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.465 ' CZ2' ' CZ ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -141.39 -93.05 0.14 Allowed 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 179.927 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.483 ' N ' ' CD ' ' A' ' 10' ' ' PRO . 37.5 mmt180 -78.24 -45.79 2.15 Favored Pre-proline 0 C--N 1.326 -0.414 0 CA-C-N 116.677 -0.238 . . . . 0.0 111.392 179.523 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.483 ' CD ' ' N ' ' A' ' 9' ' ' ARG . 84.5 Cg_endo -83.94 -164.32 0.25 Allowed 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.458 2.105 . . . . 0.0 112.3 -179.898 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 52.9 m 63.01 87.98 0.1 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.862 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.8 mm . . . . . 0 C--O 1.248 0.995 0 CA-C-O 118.18 -0.914 . . . . 0.0 110.85 179.855 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 89.9 m-70 . . . . . 0 N--CA 1.486 1.356 0 CA-C-O 120.769 0.319 . . . . 0.0 111.135 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -75.27 80.02 2.59 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.525 2.15 . . . . 0.0 112.356 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.456 ' CD1' ' C ' ' A' ' 3' ' ' LEU . 1.2 pp -95.56 -12.03 26.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.552 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -97.09 78.2 2.76 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.785 0.326 . . . . 0.0 110.756 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 179.84 -29.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.316 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 66.98 82.9 0.17 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.831 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -63.56 175.33 1.08 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.008 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.453 ' CZ2' ' CZ ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -139.29 -95.75 0.17 Allowed 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 179.942 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.467 ' HB2' ' HD3' ' A' ' 10' ' ' PRO . 37.3 mmt180 -71.41 -48.99 12.25 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.885 -0.143 . . . . 0.0 111.315 179.704 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.467 ' HD3' ' HB2' ' A' ' 9' ' ' ARG . 79.4 Cg_endo -77.73 90.78 1.23 Allowed 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 122.284 1.989 . . . . 0.0 112.373 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 53.2 m -60.48 86.86 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.884 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.8 mm . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.205 -0.902 . . . . 0.0 110.919 179.999 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 . . . . . 0 N--CA 1.486 1.335 0 CA-C-O 120.624 0.249 . . . . 0.0 111.156 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.448 ' HG3' ' CD2' ' A' ' 7' ' ' TRP . 46.3 Cg_exo -54.9 144.06 68.98 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.455 2.103 . . . . 0.0 112.262 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.476 ' CD1' ' C ' ' A' ' 3' ' ' LEU . 1.2 pp -133.37 6.48 3.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.817 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt 178.47 -32.03 0.01 OUTLIER 'General case' 0 C--O 1.231 0.099 0 CA-C-O 120.965 0.412 . . . . 0.0 111.288 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 -83.9 -31.41 25.7 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.196 -179.678 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.6 m-30 56.0 74.96 0.36 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.858 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.448 ' CD2' ' HG3' ' A' ' 2' ' ' PRO . 1.8 p90 -83.34 155.48 23.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.944 -179.773 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.456 ' CE3' ' C ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -111.14 -97.23 0.41 Allowed 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 179.954 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.512 ' N ' ' CD ' ' A' ' 10' ' ' PRO . 37.3 mmt180 -58.96 -44.51 98.99 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 120.414 0.15 . . . . 0.0 111.265 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.512 ' CD ' ' N ' ' A' ' 9' ' ' ARG . 37.4 Cg_exo -57.51 -164.44 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 122.349 2.033 . . . . 0.0 112.133 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 53.2 m -164.07 31.16 0.08 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.883 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.8 mm . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.267 -0.873 . . . . 0.0 110.887 179.94 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . 0.469 ' HB2' ' HD3' ' A' ' 2' ' ' PRO . 90.1 m-70 . . . . . 0 N--CA 1.489 1.482 0 N-CA-C 111.927 0.343 . . . . 0.0 111.927 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.469 ' HD3' ' HB2' ' A' ' 1' ' ' HIS . 97.5 Cg_endo -79.78 81.46 2.76 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 122.17 1.913 . . . . 0.0 112.371 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.458 ' CD1' ' C ' ' A' ' 3' ' ' LEU . 1.2 pp -112.29 15.36 20.4 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.678 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -95.87 -17.8 20.83 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.216 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -103.8 -15.32 15.74 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.247 -179.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 62.54 81.62 0.2 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.86 0.362 . . . . 0.0 110.779 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -59.46 162.99 4.37 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.079 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.455 ' CE3' ' C ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -124.53 -95.58 0.46 Allowed 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 179.84 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.469 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 37.3 mmt180 -62.59 -49.29 83.77 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-N 116.874 -0.148 . . . . 0.0 111.191 179.683 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.469 ' HD2' ' N ' ' A' ' 9' ' ' ARG . 76.3 Cg_endo -77.26 88.84 1.37 Allowed 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 122.238 1.958 . . . . 0.0 112.353 -179.96 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 52.3 m -76.57 -18.96 58.38 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.224 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.8 mm . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.262 -0.875 . . . . 0.0 110.893 -179.951 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . 0.478 ' HB2' ' HD3' ' A' ' 2' ' ' PRO . 90.0 m-70 . . . . . 0 N--CA 1.49 1.529 0 N-CA-C 111.852 0.315 . . . . 0.0 111.852 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.478 ' HD3' ' HB2' ' A' ' 1' ' ' HIS . 98.7 Cg_endo -79.83 83.31 2.27 Favored 'Trans proline' 0 C--N 1.349 0.565 0 C-N-CA 122.126 1.884 . . . . 0.0 112.364 -179.827 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.465 ' CD1' ' C ' ' A' ' 3' ' ' LEU . 1.2 pp -79.79 -9.66 59.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.613 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -78.56 -18.75 54.2 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.758 0.313 . . . . 0.0 111.182 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -76.49 -19.72 57.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.154 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.5 m-30 62.17 73.63 0.46 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.852 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -74.47 165.28 25.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.881 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.458 ' CE3' ' C ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -159.48 -98.26 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 -179.957 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.474 ' N ' ' CD ' ' A' ' 10' ' ' PRO . 37.3 mmt180 -58.38 -46.57 99.62 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 120.402 0.144 . . . . 0.0 111.281 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.474 ' CD ' ' N ' ' A' ' 9' ' ' ARG . 95.9 Cg_endo -85.2 -166.62 0.35 Allowed 'Trans proline' 0 N--CA 1.459 -0.504 0 C-N-CA 122.495 2.13 . . . . 0.0 112.305 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 53.2 m -165.65 32.05 0.05 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.862 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.7 mm . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.222 -0.894 . . . . 0.0 110.894 -179.985 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 . . . . . 0 N--CA 1.487 1.417 0 CA-C-O 120.676 0.274 . . . . 0.0 111.242 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -52.1 125.72 18.15 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.571 2.18 . . . . 0.0 112.25 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.472 ' CD1' ' C ' ' A' ' 3' ' ' LEU . 1.2 pp -125.01 1.57 7.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.717 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -112.48 -18.5 12.41 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.768 0.318 . . . . 0.0 111.278 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 -98.7 -20.29 17.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.098 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.51 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 6.4 m-30 62.61 18.1 10.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.207 179.935 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.51 ' CD1' ' O ' ' A' ' 6' ' ' TYR . 1.9 p90 42.21 -167.13 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.537 179.973 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.465 ' CE3' ' C ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -170.43 -99.51 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 -179.917 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.501 ' N ' ' CD ' ' A' ' 10' ' ' PRO . 37.3 mmt180 -66.14 -44.76 60.83 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 120.385 0.136 . . . . 0.0 111.19 179.819 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.501 ' CD ' ' N ' ' A' ' 9' ' ' ARG . 12.8 Cg_exo -70.09 -162.28 0.09 OUTLIER 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 122.478 2.118 . . . . 0.0 112.257 -179.903 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 52.6 m -164.84 31.92 0.06 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.84 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.8 mm . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.213 -0.899 . . . . 0.0 110.861 -179.958 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 . . . . . 0 N--CA 1.485 1.324 0 CA-C-O 120.779 0.323 . . . . 0.0 111.193 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -71.81 134.62 24.15 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.544 2.163 . . . . 0.0 112.302 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.494 ' CD1' ' C ' ' A' ' 3' ' ' LEU . 1.1 pp -90.19 2.29 55.53 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.625 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -90.41 -16.71 28.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.825 0.345 . . . . 0.0 111.001 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -143.15 106.4 4.56 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.856 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.535 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 7.1 m-30 -86.51 9.72 17.47 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.519 179.775 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.535 ' CD1' ' O ' ' A' ' 6' ' ' TYR . 1.9 p90 44.2 -170.33 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.896 0.379 . . . . 0.0 111.558 179.89 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.458 ' CE3' ' C ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -143.91 -96.7 0.11 Allowed 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 -179.891 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.501 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 37.4 mmt180 -62.75 -50.16 79.08 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-N 116.882 -0.145 . . . . 0.0 111.3 179.833 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.501 ' HD2' ' N ' ' A' ' 9' ' ' ARG . 67.0 Cg_endo -73.91 87.28 1.17 Allowed 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.258 1.972 . . . . 0.0 112.296 179.953 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 52.6 m -86.6 -18.46 31.37 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.239 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.8 mm . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.248 -0.882 . . . . 0.0 110.907 -179.959 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 . . . . . 0 N--CA 1.486 1.334 0 CA-C-O 120.696 0.284 . . . . 0.0 111.164 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -70.3 103.34 1.24 Allowed 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.577 2.185 . . . . 0.0 112.311 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.451 ' CD1' ' C ' ' A' ' 3' ' ' LEU . 1.2 pp -100.02 16.98 22.2 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.524 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -105.51 -16.77 14.63 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.306 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 -91.81 -20.21 21.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.299 -179.833 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 60.17 75.99 0.38 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.734 -179.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -73.05 -176.17 2.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.974 -179.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.534 ' CH2' ' CZ ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -158.34 -96.61 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 179.745 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.534 ' CZ ' ' CH2' ' A' ' 8' ' ' TRP . 38.1 mmt180 -92.31 -48.59 0.31 Allowed Pre-proline 0 C--N 1.33 -0.242 0 N-CA-C 111.496 0.184 . . . . 0.0 111.496 178.521 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.492 ' HD3' ' HB2' ' A' ' 9' ' ' ARG . 93.4 Cg_endo -85.47 90.73 0.72 Allowed 'Trans proline' 0 C--N 1.349 0.574 0 C-N-CA 122.436 2.091 . . . . 0.0 112.424 -179.908 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 53.2 m -79.2 66.74 4.73 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.838 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.9 mm . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.254 -0.879 . . . . 0.0 110.938 179.998 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 . . . . . 0 N--CA 1.487 1.411 0 CA-C-O 120.693 0.282 . . . . 0.0 111.22 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -75.65 97.36 1.1 Allowed 'Trans proline' 0 C--N 1.343 0.264 0 C-N-CA 122.657 2.238 . . . . 0.0 112.36 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.441 ' CD1' ' C ' ' A' ' 3' ' ' LEU . 1.2 pp -116.6 -17.24 10.63 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.818 -179.944 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.43 ' N ' HD11 ' A' ' 3' ' ' LEU . 87.4 tttt -137.09 -14.56 1.55 Allowed 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -179.757 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 -101.69 -30.33 11.39 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.897 0.38 . . . . 0.0 111.114 -179.778 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.518 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 6.6 m-30 55.4 33.13 20.22 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.988 179.98 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.518 ' CD1' ' O ' ' A' ' 6' ' ' TYR . 1.9 p90 43.37 -169.05 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.51 -179.931 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.454 ' CE3' ' C ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -150.3 -95.9 0.07 Allowed 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 -179.903 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.477 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 37.3 mmt180 -71.9 -49.67 10.22 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.879 -0.146 . . . . 0.0 111.202 179.581 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.477 ' HD2' ' N ' ' A' ' 9' ' ' ARG . 71.8 Cg_endo -76.43 83.74 1.99 Allowed 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 122.281 1.988 . . . . 0.0 112.42 -179.972 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 53.4 m -103.65 138.45 40.3 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.918 -179.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.8 mm . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.276 -0.869 . . . . 0.0 110.823 -180.0 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 . . . . . 0 N--CA 1.486 1.367 0 CA-C-O 120.621 0.248 . . . . 0.0 111.201 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_exo -47.74 159.99 0.49 Allowed 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.606 2.204 . . . . 0.0 112.343 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.471 ' CD1' ' C ' ' A' ' 3' ' ' LEU . 1.2 pp -134.3 9.68 3.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.781 -179.926 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -127.7 -13.3 5.34 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 111.742 0.275 . . . . 0.0 111.742 -179.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -70.21 -31.33 68.72 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.91 0.386 . . . . 0.0 111.138 -179.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.9 m-30 54.67 80.52 0.12 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.041 179.91 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -104.27 161.75 13.78 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.665 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.537 ' CH2' ' CZ ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -112.31 -97.84 0.42 Allowed 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 -179.962 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.537 ' CZ ' ' CH2' ' A' ' 8' ' ' TRP . 38.1 mmt180 -88.61 -48.09 0.43 Allowed Pre-proline 0 CA--C 1.532 0.268 0 CA-C-N 116.915 -0.13 . . . . 0.0 111.292 178.709 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.472 ' HD3' ' HB2' ' A' ' 9' ' ' ARG . 91.0 Cg_endo -83.39 97.43 0.8 Allowed 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 122.391 2.061 . . . . 0.0 112.509 -179.718 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 52.8 m -80.01 141.35 36.02 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.8 179.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.416 HG23 HD11 ' A' ' 12' ' ' ILE . 48.7 mm . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.259 -0.877 . . . . 0.0 110.978 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . 0.476 ' HB2' ' HD3' ' A' ' 2' ' ' PRO . 90.0 m-70 . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 111.947 0.351 . . . . 0.0 111.947 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.476 ' HD3' ' HB2' ' A' ' 1' ' ' HIS . 95.0 Cg_endo -80.46 57.8 6.69 Favored 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 122.182 1.921 . . . . 0.0 112.361 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.462 ' CD1' ' C ' ' A' ' 3' ' ' LEU . 1.2 pp -110.1 12.94 23.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.645 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -76.75 -18.75 58.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.765 0.317 . . . . 0.0 111.137 179.892 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.414 ' O ' ' HG2' ' A' ' 5' ' ' GLN . 41.4 tt0 -112.03 -4.2 14.55 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.269 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 65.52 91.84 0.08 Allowed 'General case' 0 C--O 1.231 0.116 0 CA-C-O 120.838 0.351 . . . . 0.0 110.812 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -65.8 -177.88 0.51 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.01 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.46 ' CE3' ' C ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -171.29 -98.12 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 179.954 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.527 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 37.3 mmt180 -62.88 -55.36 38.77 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 120.354 0.121 . . . . 0.0 111.204 179.828 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.527 ' HD2' ' N ' ' A' ' 9' ' ' ARG . 19.7 Cg_endo -58.89 -76.71 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 122.267 1.978 . . . . 0.0 112.346 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 53.4 m 61.25 170.55 0.1 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.88 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.8 mm . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.846 179.978 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 89.9 m-70 . . . . . 0 N--CA 1.486 1.371 0 CA-C-O 120.641 0.258 . . . . 0.0 111.123 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_endo -78.5 56.93 6.07 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.58 2.187 . . . . 0.0 112.43 -179.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.448 ' CD1' ' C ' ' A' ' 3' ' ' LEU . 1.2 pp -113.45 16.45 18.85 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.558 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -74.57 -19.67 60.24 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.11 179.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.421 ' O ' ' HB2' ' A' ' 6' ' ' TYR . 41.5 tt0 -116.89 -4.6 11.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.084 179.862 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.483 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 6.2 m-30 70.32 8.32 6.58 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.503 -179.981 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.483 ' CD1' ' O ' ' A' ' 6' ' ' TYR . 1.9 p90 40.66 -165.0 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.819 0.342 . . . . 0.0 111.611 179.66 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.454 ' CZ2' ' CZ ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -170.5 -95.56 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 -179.991 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.474 ' HB2' ' HD3' ' A' ' 10' ' ' PRO . 37.4 mmt180 -72.84 -49.06 8.05 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 116.849 -0.159 . . . . 0.0 111.173 179.548 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.474 ' HD3' ' HB2' ' A' ' 9' ' ' ARG . 91.3 Cg_endo -78.48 81.69 2.68 Favored 'Trans proline' 0 C--N 1.349 0.557 0 C-N-CA 122.223 1.949 . . . . 0.0 112.396 -179.998 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 52.8 m -76.0 112.87 12.88 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.814 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.8 mm . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.203 -0.903 . . . . 0.0 110.952 -179.91 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 . . . . . 0 N--CA 1.485 1.323 0 CA-C-O 120.661 0.267 . . . . 0.0 111.261 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -67.99 124.67 12.08 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.606 2.204 . . . . 0.0 112.237 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.464 ' CD1' ' C ' ' A' ' 3' ' ' LEU . 1.2 pp -74.0 -10.53 59.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.646 -179.949 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -82.5 -17.49 44.93 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.702 0.287 . . . . 0.0 111.273 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 -97.42 93.73 6.64 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.953 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.539 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 6.5 m-30 -71.14 -12.58 61.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.207 179.841 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.539 ' CD1' ' O ' ' A' ' 6' ' ' TYR . 1.9 p90 44.38 -170.69 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 120.998 0.428 . . . . 0.0 111.512 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' TRP . . . . . 0.455 ' CE3' ' C ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -154.99 -94.91 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 -179.841 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.53 ' HB2' ' HD3' ' A' ' 10' ' ' PRO . 37.3 mmt180 -60.0 -47.07 97.92 Favored Pre-proline 0 C--N 1.328 -0.37 0 CA-C-N 116.905 -0.134 . . . . 0.0 111.129 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.53 ' HD3' ' HB2' ' A' ' 9' ' ' ARG . 2.1 Cg_endo -83.02 112.63 2.05 Favored 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.864 2.376 . . . . 0.0 112.039 -179.866 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 52.5 m -94.94 -23.06 17.58 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.098 -179.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.7 mm . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.24 -0.886 . . . . 0.0 110.82 179.957 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 . . . . . 0 N--CA 1.487 1.387 0 CA-C-O 120.736 0.303 . . . . 0.0 111.209 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -52.66 130.46 36.99 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 122.527 2.151 . . . . 0.0 112.259 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.63 ' C ' HD12 ' A' ' 3' ' ' LEU . 1.2 pp -131.52 13.09 4.98 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.654 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -113.63 -16.83 12.28 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.353 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 -80.66 -24.81 38.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.098 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.6 m-30 58.62 88.8 0.06 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.839 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -80.85 171.55 14.86 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.904 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.455 ' C ' ' CE3' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -132.36 -99.74 0.28 Allowed 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 179.99 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.527 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 37.3 mmt180 -64.84 -51.02 60.22 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 120.426 0.155 . . . . 0.0 111.3 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.527 ' HD2' ' N ' ' A' ' 9' ' ' ARG . 59.7 Cg_endo . . . . . 0 C--N 1.348 0.534 0 C-N-CA 122.221 1.947 . . . . 0.0 112.242 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.2 m-70 . . . . . 0 N--CA 1.488 1.466 0 CA-C-O 120.787 0.327 . . . . 0.0 111.255 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -70.12 97.8 0.69 Allowed 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.588 2.192 . . . . 0.0 112.291 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.738 HD12 ' N ' ' A' ' 4' ' ' LYS . 1.2 pp -73.75 -11.49 60.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.598 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.738 ' N ' HD12 ' A' ' 3' ' ' LEU . 87.4 tttt -96.1 -19.39 19.45 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.75 0.31 . . . . 0.0 111.32 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -67.14 -23.12 65.76 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.063 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.6 m-30 60.15 74.58 0.44 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.781 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -60.59 177.01 0.32 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.927 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.452 ' C ' ' CE3' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -137.85 -95.52 0.2 Allowed 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 179.841 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.509 ' HB2' ' HD3' ' A' ' 10' ' ' PRO . 37.3 mmt180 -58.13 -48.86 96.3 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.857 -0.156 . . . . 0.0 111.255 179.792 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.509 ' HD3' ' HB2' ' A' ' 9' ' ' ARG . 91.2 Cg_endo . . . . . 0 C--N 1.348 0.52 0 C-N-CA 122.302 2.001 . . . . 0.0 112.343 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.672 0.272 . . . . 0.0 111.219 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.43 73.58 1.21 Allowed 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.615 2.21 . . . . 0.0 112.333 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.629 ' C ' HD12 ' A' ' 3' ' ' LEU . 1.2 pp -104.3 11.37 34.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.582 -179.952 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -93.9 -18.91 21.46 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.743 0.306 . . . . 0.0 111.168 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -107.24 -12.35 15.39 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.282 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 63.93 88.25 0.1 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.879 0.371 . . . . 0.0 110.872 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -65.6 -176.35 0.34 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.926 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.464 ' CZ2' ' CZ ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -175.88 -95.67 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.503 -0.555 . . . . 0.0 109.503 179.904 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.493 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 37.4 mmt180 -73.13 -49.65 7.04 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 116.925 -0.125 . . . . 0.0 111.303 179.657 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.493 ' HD2' ' N ' ' A' ' 9' ' ' ARG . 72.9 Cg_endo . . . . . 0 C--N 1.348 0.533 0 C-N-CA 122.122 1.881 . . . . 0.0 112.65 -179.887 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 . . . . . 0 N--CA 1.486 1.335 0 CA-C-O 120.763 0.316 . . . . 0.0 111.237 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -71.17 115.38 4.25 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.62 2.213 . . . . 0.0 112.237 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.621 ' C ' HD12 ' A' ' 3' ' ' LEU . 1.2 pp -94.7 12.76 26.65 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.573 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -111.69 -17.87 12.89 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.69 0.281 . . . . 0.0 111.29 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -68.75 -27.71 66.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.935 0.397 . . . . 0.0 111.081 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.6 m-30 57.09 63.65 1.85 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.889 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -61.47 154.81 23.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.968 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.458 ' C ' ' CE3' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -149.69 -97.16 0.07 Allowed 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.681 179.967 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.522 ' HB2' ' HD3' ' A' ' 10' ' ' PRO . 37.3 mmt180 -57.31 -47.67 98.63 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 120.379 0.133 . . . . 0.0 111.261 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.522 ' HD3' ' HB2' ' A' ' 9' ' ' ARG . 91.1 Cg_endo . . . . . 0 C--N 1.347 0.493 0 C-N-CA 122.414 2.076 . . . . 0.0 112.109 179.833 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 1' ' ' HIS . . . . . 0.402 ' HA ' ' HD2' ' A' ' 2' ' ' PRO . 90.0 m-70 . . . . . 0 N--CA 1.488 1.452 0 CA-C-O 120.655 0.264 . . . . 0.0 111.173 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 2' ' ' PRO . . . . . 0.402 ' HD2' ' HA ' ' A' ' 1' ' ' HIS . 43.2 Cg_endo -67.78 113.09 2.86 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.473 2.115 . . . . 0.0 112.247 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.621 ' C ' HD12 ' A' ' 3' ' ' LEU . 1.2 pp -103.65 15.61 28.42 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.712 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -87.37 -18.61 29.64 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.789 0.328 . . . . 0.0 111.186 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 -84.63 -21.51 30.27 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.176 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 60.87 84.92 0.12 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.851 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -81.8 174.97 10.82 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.931 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.449 ' C ' ' CE3' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -176.95 -94.41 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.935 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.527 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 37.2 mmt180 -69.18 -50.0 22.26 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 116.728 -0.214 . . . . 0.0 111.455 179.868 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.527 ' HD2' ' N ' ' A' ' 9' ' ' ARG . 60.4 Cg_endo . . . . . 0 C--N 1.349 0.569 0 C-N-CA 122.156 1.904 . . . . 0.0 112.639 -179.823 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 120.735 0.302 . . . . 0.0 111.249 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -68.47 161.91 42.97 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.537 2.158 . . . . 0.0 112.245 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.618 ' C ' HD12 ' A' ' 3' ' ' LEU . 1.2 pp -141.13 15.78 2.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.71 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -109.84 -18.16 13.48 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.269 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -78.51 -19.39 53.09 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.13 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.5 m-30 61.93 80.5 0.22 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.85 0.357 . . . . 0.0 110.822 -179.868 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -61.21 175.29 0.56 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.074 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.444 ' C ' ' CE3' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -176.92 -94.51 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 179.934 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.526 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 37.3 mmt180 -66.85 -50.55 43.08 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 116.724 -0.217 . . . . 0.0 111.447 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.526 ' HD2' ' N ' ' A' ' 9' ' ' ARG . 59.2 Cg_endo . . . . . 0 C--N 1.347 0.47 0 C-N-CA 122.161 1.907 . . . . 0.0 112.636 -179.789 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 . . . . . 0 N--CA 1.487 1.386 0 CA-C-O 120.708 0.29 . . . . 0.0 111.179 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_endo -80.79 53.97 5.02 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.652 2.235 . . . . 0.0 112.589 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.721 HD12 ' N ' ' A' ' 4' ' ' LYS . 1.2 pp -88.0 -11.05 48.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.564 179.793 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.721 ' N ' HD12 ' A' ' 3' ' ' LEU . 87.4 tttt -112.63 -18.94 12.24 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.175 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -73.19 -20.47 60.88 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.094 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 62.21 83.29 0.16 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.886 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -68.77 -175.59 0.71 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.894 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.465 ' CZ2' ' CZ ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -141.39 -93.05 0.14 Allowed 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 179.927 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.483 ' N ' ' CD ' ' A' ' 10' ' ' PRO . 37.5 mmt180 -78.24 -45.79 2.15 Favored Pre-proline 0 C--N 1.326 -0.414 0 CA-C-N 116.677 -0.238 . . . . 0.0 111.392 179.523 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.483 ' CD ' ' N ' ' A' ' 9' ' ' ARG . 84.5 Cg_endo . . . . . 0 C--N 1.347 0.461 0 C-N-CA 122.458 2.105 . . . . 0.0 112.3 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 89.9 m-70 . . . . . 0 N--CA 1.486 1.356 0 CA-C-O 120.769 0.319 . . . . 0.0 111.135 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -75.27 80.02 2.59 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.525 2.15 . . . . 0.0 112.356 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.732 HD12 ' N ' ' A' ' 4' ' ' LYS . 1.2 pp -95.56 -12.03 26.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.552 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.732 ' N ' HD12 ' A' ' 3' ' ' LEU . 87.4 tttt -97.09 78.2 2.76 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.785 0.326 . . . . 0.0 110.756 179.906 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 179.84 -29.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.316 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 66.98 82.9 0.17 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.831 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -63.56 175.33 1.08 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.008 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.453 ' CZ2' ' CZ ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -139.29 -95.75 0.17 Allowed 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 179.942 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.502 ' HB2' ' HD3' ' A' ' 10' ' ' PRO . 37.3 mmt180 -71.41 -48.99 12.25 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.885 -0.143 . . . . 0.0 111.315 179.704 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.502 ' HD3' ' HB2' ' A' ' 9' ' ' ARG . 79.4 Cg_endo . . . . . 0 C--N 1.349 0.563 0 C-N-CA 122.284 1.989 . . . . 0.0 112.373 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 . . . . . 0 N--CA 1.486 1.335 0 CA-C-O 120.624 0.249 . . . . 0.0 111.156 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' PRO . . . . . 0.446 ' HG3' ' CD2' ' A' ' 7' ' ' TRP . 46.3 Cg_exo -54.9 144.06 68.98 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.455 2.103 . . . . 0.0 112.262 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.64 ' C ' HD12 ' A' ' 3' ' ' LEU . 1.2 pp -133.37 6.48 3.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.817 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.404 ' HB2' ' O ' ' A' ' 3' ' ' LEU . 87.4 tttt 178.47 -32.03 0.01 OUTLIER 'General case' 0 C--O 1.231 0.099 0 CA-C-O 120.965 0.412 . . . . 0.0 111.288 179.854 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 -83.9 -31.41 25.7 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.196 -179.678 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.431 ' HA ' ' HB3' ' A' ' 2' ' ' PRO . 6.6 m-30 56.0 74.96 0.36 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.858 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.446 ' CD2' ' HG3' ' A' ' 2' ' ' PRO . 1.8 p90 -83.34 155.48 23.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.944 -179.773 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.456 ' C ' ' CE3' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -111.14 -97.23 0.41 Allowed 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 179.954 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.512 ' N ' ' CD ' ' A' ' 10' ' ' PRO . 37.3 mmt180 -58.96 -44.51 98.99 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 120.414 0.15 . . . . 0.0 111.265 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.512 ' CD ' ' N ' ' A' ' 9' ' ' ARG . 37.4 Cg_exo . . . . . 0 C--N 1.348 0.546 0 C-N-CA 122.349 2.033 . . . . 0.0 112.133 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 1' ' ' HIS . . . . . 0.499 ' HB2' ' HD3' ' A' ' 2' ' ' PRO . 90.1 m-70 . . . . . 0 N--CA 1.489 1.482 0 N-CA-C 111.927 0.343 . . . . 0.0 111.927 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 2' ' ' PRO . . . . . 0.499 ' HD3' ' HB2' ' A' ' 1' ' ' HIS . 97.5 Cg_endo -79.78 81.46 2.76 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 122.17 1.913 . . . . 0.0 112.371 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.62 ' C ' HD12 ' A' ' 3' ' ' LEU . 1.2 pp -112.29 15.36 20.4 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.678 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -95.87 -17.8 20.83 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.216 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -103.8 -15.32 15.74 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.247 -179.852 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 62.54 81.62 0.2 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.86 0.362 . . . . 0.0 110.779 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -59.46 162.99 4.37 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.079 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.455 ' C ' ' CE3' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -124.53 -95.58 0.46 Allowed 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 179.84 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.504 ' HB2' ' HD3' ' A' ' 10' ' ' PRO . 37.3 mmt180 -62.59 -49.29 83.77 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-N 116.874 -0.148 . . . . 0.0 111.191 179.683 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.504 ' HD3' ' HB2' ' A' ' 9' ' ' ARG . 76.3 Cg_endo . . . . . 0 C--N 1.349 0.576 0 C-N-CA 122.238 1.958 . . . . 0.0 112.353 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 1' ' ' HIS . . . . . 0.519 ' HB2' ' HD3' ' A' ' 2' ' ' PRO . 90.0 m-70 . . . . . 0 N--CA 1.49 1.529 0 N-CA-C 111.852 0.315 . . . . 0.0 111.852 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 2' ' ' PRO . . . . . 0.519 ' HD3' ' HB2' ' A' ' 1' ' ' HIS . 98.7 Cg_endo -79.83 83.31 2.27 Favored 'Trans proline' 0 C--N 1.349 0.565 0 C-N-CA 122.126 1.884 . . . . 0.0 112.364 -179.827 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.684 HD12 ' N ' ' A' ' 4' ' ' LYS . 1.2 pp -79.79 -9.66 59.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.613 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.684 ' N ' HD12 ' A' ' 3' ' ' LEU . 87.3 tttt -78.56 -18.75 54.2 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.758 0.313 . . . . 0.0 111.182 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -76.49 -19.72 57.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.154 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.5 m-30 62.17 73.63 0.46 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.852 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -74.47 165.28 25.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.881 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.458 ' C ' ' CE3' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -159.48 -98.26 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 -179.957 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.499 ' HB2' ' HD3' ' A' ' 10' ' ' PRO . 37.3 mmt180 -58.38 -46.57 99.62 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 120.402 0.144 . . . . 0.0 111.281 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.499 ' HD3' ' HB2' ' A' ' 9' ' ' ARG . 95.9 Cg_endo . . . . . 0 N--CA 1.459 -0.504 0 C-N-CA 122.495 2.13 . . . . 0.0 112.305 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 . . . . . 0 N--CA 1.487 1.417 0 CA-C-O 120.676 0.274 . . . . 0.0 111.242 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -52.1 125.72 18.15 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.571 2.18 . . . . 0.0 112.25 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.638 ' C ' HD12 ' A' ' 3' ' ' LEU . 1.2 pp -125.01 1.57 7.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.717 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.5 ' N ' HD12 ' A' ' 3' ' ' LEU . 87.4 tttt -112.48 -18.5 12.41 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.768 0.318 . . . . 0.0 111.278 -179.916 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 -98.7 -20.29 17.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.098 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.51 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 6.4 m-30 62.61 18.1 10.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.207 179.935 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.51 ' CD1' ' O ' ' A' ' 6' ' ' TYR . 1.9 p90 42.21 -167.13 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.537 179.973 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.465 ' C ' ' CE3' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -170.43 -99.51 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 -179.917 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.501 ' N ' ' CD ' ' A' ' 10' ' ' PRO . 37.3 mmt180 -66.14 -44.76 60.83 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 120.385 0.136 . . . . 0.0 111.19 179.819 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.501 ' CD ' ' N ' ' A' ' 9' ' ' ARG . 12.8 Cg_exo . . . . . 0 C--N 1.348 0.52 0 C-N-CA 122.478 2.118 . . . . 0.0 112.257 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 . . . . . 0 N--CA 1.485 1.324 0 CA-C-O 120.779 0.323 . . . . 0.0 111.193 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -71.81 134.62 24.15 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.544 2.163 . . . . 0.0 112.302 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.669 ' C ' HD12 ' A' ' 3' ' ' LEU . 1.1 pp -90.19 2.29 55.53 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.625 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.5 ' N ' HD12 ' A' ' 3' ' ' LEU . 87.4 tttt -90.41 -16.71 28.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.825 0.345 . . . . 0.0 111.001 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -143.15 106.4 4.56 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.856 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.535 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 7.1 m-30 -86.51 9.72 17.47 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.519 179.775 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.535 ' CD1' ' O ' ' A' ' 6' ' ' TYR . 1.9 p90 44.2 -170.33 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.896 0.379 . . . . 0.0 111.558 179.89 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.458 ' C ' ' CE3' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -143.91 -96.7 0.11 Allowed 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 -179.891 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.52 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 37.4 mmt180 -62.75 -50.16 79.08 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-N 116.882 -0.145 . . . . 0.0 111.3 179.833 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.52 ' HD2' ' N ' ' A' ' 9' ' ' ARG . 67.0 Cg_endo . . . . . 0 C--N 1.348 0.533 0 C-N-CA 122.258 1.972 . . . . 0.0 112.296 179.953 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 . . . . . 0 N--CA 1.486 1.334 0 CA-C-O 120.696 0.284 . . . . 0.0 111.164 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -70.3 103.34 1.24 Allowed 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.577 2.185 . . . . 0.0 112.311 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.615 ' C ' HD12 ' A' ' 3' ' ' LEU . 1.2 pp -100.02 16.98 22.2 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.524 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -105.51 -16.77 14.63 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.306 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 -91.81 -20.21 21.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.299 -179.833 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 60.17 75.99 0.38 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.734 -179.856 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -73.05 -176.17 2.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.974 -179.858 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.534 ' CH2' ' CZ ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -158.34 -96.61 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 179.745 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.534 ' CZ ' ' CH2' ' A' ' 8' ' ' TRP . 38.1 mmt180 -92.31 -48.59 0.31 Allowed Pre-proline 0 C--N 1.33 -0.242 0 N-CA-C 111.496 0.184 . . . . 0.0 111.496 178.521 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.516 ' HD3' ' HB2' ' A' ' 9' ' ' ARG . 93.4 Cg_endo . . . . . 0 C--N 1.349 0.574 0 C-N-CA 122.436 2.091 . . . . 0.0 112.424 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 . . . . . 0 N--CA 1.487 1.411 0 CA-C-O 120.693 0.282 . . . . 0.0 111.22 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -75.65 97.36 1.1 Allowed 'Trans proline' 0 C--N 1.343 0.264 0 C-N-CA 122.657 2.238 . . . . 0.0 112.36 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.819 HD12 ' N ' ' A' ' 4' ' ' LYS . 1.2 pp -116.6 -17.24 10.63 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.818 -179.944 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.819 ' N ' HD12 ' A' ' 3' ' ' LEU . 87.4 tttt -137.09 -14.56 1.55 Allowed 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -179.757 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 -101.69 -30.33 11.39 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.897 0.38 . . . . 0.0 111.114 -179.778 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.518 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 6.6 m-30 55.4 33.13 20.22 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.988 179.98 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.518 ' CD1' ' O ' ' A' ' 6' ' ' TYR . 1.9 p90 43.37 -169.05 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.51 -179.931 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.454 ' C ' ' CE3' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -150.3 -95.9 0.07 Allowed 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 -179.903 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.498 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 37.3 mmt180 -71.9 -49.67 10.22 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.879 -0.146 . . . . 0.0 111.202 179.581 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.498 ' HD2' ' N ' ' A' ' 9' ' ' ARG . 71.8 Cg_endo . . . . . 0 C--N 1.348 0.517 0 C-N-CA 122.281 1.988 . . . . 0.0 112.42 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 . . . . . 0 N--CA 1.486 1.367 0 CA-C-O 120.621 0.248 . . . . 0.0 111.201 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_exo -47.74 159.99 0.49 Allowed 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.606 2.204 . . . . 0.0 112.343 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.644 ' C ' HD12 ' A' ' 3' ' ' LEU . 1.2 pp -134.3 9.68 3.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.781 -179.926 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -127.7 -13.3 5.34 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 111.742 0.275 . . . . 0.0 111.742 -179.78 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 17.8 tt0 -70.21 -31.33 68.72 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.91 0.386 . . . . 0.0 111.138 -179.822 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.9 m-30 54.67 80.52 0.12 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.041 179.91 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -104.27 161.75 13.78 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.665 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.537 ' CH2' ' CZ ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -112.31 -97.84 0.42 Allowed 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 -179.962 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.537 ' CZ ' ' CH2' ' A' ' 8' ' ' TRP . 38.1 mmt180 -88.61 -48.09 0.43 Allowed Pre-proline 0 CA--C 1.532 0.268 0 CA-C-N 116.915 -0.13 . . . . 0.0 111.292 178.709 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.495 ' HD3' ' HB2' ' A' ' 9' ' ' ARG . 91.0 Cg_endo . . . . . 0 C--N 1.349 0.598 0 C-N-CA 122.391 2.061 . . . . 0.0 112.509 -179.718 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 1' ' ' HIS . . . . . 0.504 ' HB2' ' HD3' ' A' ' 2' ' ' PRO . 90.0 m-70 . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 111.947 0.351 . . . . 0.0 111.947 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 2' ' ' PRO . . . . . 0.504 ' HD3' ' HB2' ' A' ' 1' ' ' HIS . 95.0 Cg_endo -80.46 57.8 6.69 Favored 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 122.182 1.921 . . . . 0.0 112.361 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.633 ' C ' HD12 ' A' ' 3' ' ' LEU . 1.2 pp -110.1 12.94 23.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.645 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -76.75 -18.75 58.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.765 0.317 . . . . 0.0 111.137 179.892 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' GLN . . . . . 0.429 ' HG2' ' O ' ' A' ' 5' ' ' GLN . 41.4 tt0 -112.03 -4.2 14.55 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.269 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 65.52 91.84 0.08 Allowed 'General case' 0 C--O 1.231 0.116 0 CA-C-O 120.838 0.351 . . . . 0.0 110.812 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -65.8 -177.88 0.51 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.01 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.46 ' C ' ' CE3' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -171.29 -98.12 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 179.954 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.54 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 37.3 mmt180 -62.88 -55.36 38.77 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 120.354 0.121 . . . . 0.0 111.204 179.828 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.54 ' HD2' ' N ' ' A' ' 9' ' ' ARG . 19.7 Cg_endo . . . . . 0 C--N 1.348 0.543 0 C-N-CA 122.267 1.978 . . . . 0.0 112.346 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 89.9 m-70 . . . . . 0 N--CA 1.486 1.371 0 CA-C-O 120.641 0.258 . . . . 0.0 111.123 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_endo -78.5 56.93 6.07 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.58 2.187 . . . . 0.0 112.43 -179.879 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.611 ' C ' HD12 ' A' ' 3' ' ' LEU . 1.2 pp -113.45 16.45 18.85 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.558 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -74.57 -19.67 60.24 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.11 179.874 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' GLN . . . . . 0.425 ' O ' ' HB2' ' A' ' 6' ' ' TYR . 41.5 tt0 -116.89 -4.6 11.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.084 179.862 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.483 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 6.2 m-30 70.32 8.32 6.58 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.503 -179.981 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.483 ' CD1' ' O ' ' A' ' 6' ' ' TYR . 1.9 p90 40.66 -165.0 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.819 0.342 . . . . 0.0 111.611 179.66 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.454 ' CZ2' ' CZ ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -170.5 -95.56 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 -179.991 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.495 ' HB2' ' HD3' ' A' ' 10' ' ' PRO . 37.4 mmt180 -72.84 -49.06 8.05 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 116.849 -0.159 . . . . 0.0 111.173 179.548 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.495 ' HD3' ' HB2' ' A' ' 9' ' ' ARG . 91.3 Cg_endo . . . . . 0 C--N 1.349 0.557 0 C-N-CA 122.223 1.949 . . . . 0.0 112.396 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 . . . . . 0 N--CA 1.485 1.323 0 CA-C-O 120.661 0.267 . . . . 0.0 111.261 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -67.99 124.67 12.08 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.606 2.204 . . . . 0.0 112.237 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.719 HD12 ' N ' ' A' ' 4' ' ' LYS . 1.2 pp -74.0 -10.53 59.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.646 -179.949 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.719 ' N ' HD12 ' A' ' 3' ' ' LEU . 87.4 tttt -82.5 -17.49 44.93 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.702 0.287 . . . . 0.0 111.273 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 -97.42 93.73 6.64 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.953 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.539 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 6.5 m-30 -71.14 -12.58 61.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.207 179.841 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' TRP . . . . . 0.539 ' CD1' ' O ' ' A' ' 6' ' ' TYR . 1.9 p90 44.38 -170.69 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 120.998 0.428 . . . . 0.0 111.512 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' TRP . . . . . 0.455 ' C ' ' CE3' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -154.99 -94.91 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 -179.841 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.527 ' HB2' ' HD3' ' A' ' 10' ' ' PRO . 37.3 mmt180 -60.0 -47.07 97.92 Favored Pre-proline 0 C--N 1.328 -0.37 0 CA-C-N 116.905 -0.134 . . . . 0.0 111.129 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.527 ' HD3' ' HB2' ' A' ' 9' ' ' ARG . 2.1 Cg_endo . . . . . 0 C--N 1.348 0.514 0 C-N-CA 122.864 2.376 . . . . 0.0 112.039 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 . . . . . 0 N--CA 1.487 1.387 0 CA-C-O 120.736 0.303 . . . . 0.0 111.209 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -52.66 130.46 36.99 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 122.527 2.151 . . . . 0.0 112.259 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.63 ' C ' HD12 ' A' ' 3' ' ' LEU . 1.2 pp -131.52 13.09 4.98 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.654 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -113.63 -16.83 12.28 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.353 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 -80.66 -24.81 38.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.098 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.6 m-30 58.62 88.8 0.06 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.839 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -80.85 171.55 14.86 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.904 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.455 ' C ' ' CE3' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -132.36 -99.74 0.28 Allowed 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 179.99 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.527 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 37.3 mmt180 -64.84 -51.02 60.22 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 120.426 0.155 . . . . 0.0 111.3 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.527 ' HD2' ' N ' ' A' ' 9' ' ' ARG . 59.7 Cg_endo -72.26 84.71 1.11 Allowed 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 122.221 1.947 . . . . 0.0 112.242 -179.898 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 52.9 m -121.47 121.52 37.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.851 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.8 mm . . . . . 0 C--O 1.251 1.139 0 CA-C-O 118.181 -0.914 . . . . 0.0 110.836 179.994 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.2 m-70 . . . . . 0 N--CA 1.488 1.466 0 CA-C-O 120.787 0.327 . . . . 0.0 111.255 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -70.12 97.8 0.69 Allowed 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.588 2.192 . . . . 0.0 112.291 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.738 HD12 ' N ' ' A' ' 4' ' ' LYS . 1.2 pp -73.75 -11.49 60.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.598 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.738 ' N ' HD12 ' A' ' 3' ' ' LEU . 87.4 tttt -96.1 -19.39 19.45 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.75 0.31 . . . . 0.0 111.32 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -67.14 -23.12 65.76 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.063 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.6 m-30 60.15 74.58 0.44 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.781 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -60.59 177.01 0.32 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.927 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.452 ' C ' ' CE3' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -137.85 -95.52 0.2 Allowed 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 179.841 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.509 ' HB2' ' HD3' ' A' ' 10' ' ' PRO . 37.3 mmt180 -58.13 -48.86 96.3 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.857 -0.156 . . . . 0.0 111.255 179.792 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.509 ' HD3' ' HB2' ' A' ' 9' ' ' ARG . 91.2 Cg_endo -78.18 76.98 4.14 Favored 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 122.302 2.001 . . . . 0.0 112.343 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 52.4 m -86.54 116.67 24.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.855 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.7 mm . . . . . 0 C--O 1.25 1.086 0 CA-C-O 118.28 -0.867 . . . . 0.0 110.919 179.953 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.672 0.272 . . . . 0.0 111.219 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.43 73.58 1.21 Allowed 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.615 2.21 . . . . 0.0 112.333 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.629 ' C ' HD12 ' A' ' 3' ' ' LEU . 1.2 pp -104.3 11.37 34.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.582 -179.952 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -93.9 -18.91 21.46 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.743 0.306 . . . . 0.0 111.168 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -107.24 -12.35 15.39 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.282 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 63.93 88.25 0.1 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.879 0.371 . . . . 0.0 110.872 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -65.6 -176.35 0.34 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.926 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.464 ' CZ2' ' CZ ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -175.88 -95.67 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.503 -0.555 . . . . 0.0 109.503 179.904 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.493 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 37.4 mmt180 -73.13 -49.65 7.04 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 116.925 -0.125 . . . . 0.0 111.303 179.657 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.493 ' HD2' ' N ' ' A' ' 9' ' ' ARG . 72.9 Cg_endo -75.99 -13.25 19.47 Favored 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.122 1.881 . . . . 0.0 112.65 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.438 ' O ' HD13 ' A' ' 12' ' ' ILE . 52.8 m 62.19 31.11 17.74 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.97 179.913 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.438 HD13 ' O ' ' A' ' 11' ' ' SER . 48.7 mm . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.852 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 . . . . . 0 N--CA 1.486 1.335 0 CA-C-O 120.763 0.316 . . . . 0.0 111.237 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -71.17 115.38 4.25 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.62 2.213 . . . . 0.0 112.237 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.621 ' C ' HD12 ' A' ' 3' ' ' LEU . 1.2 pp -94.7 12.76 26.65 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.573 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -111.69 -17.87 12.89 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.69 0.281 . . . . 0.0 111.29 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -68.75 -27.71 66.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.935 0.397 . . . . 0.0 111.081 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.6 m-30 57.09 63.65 1.85 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.889 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -61.47 154.81 23.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.968 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.458 ' C ' ' CE3' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -149.69 -97.16 0.07 Allowed 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.681 179.967 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.522 ' HB2' ' HD3' ' A' ' 10' ' ' PRO . 37.3 mmt180 -57.31 -47.67 98.63 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 120.379 0.133 . . . . 0.0 111.261 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.522 ' HD3' ' HB2' ' A' ' 9' ' ' ARG . 91.1 Cg_endo -83.23 -164.17 0.25 Allowed 'Trans proline' 0 C--N 1.347 0.493 0 C-N-CA 122.414 2.076 . . . . 0.0 112.109 179.833 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 52.9 m -164.67 103.82 0.81 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.883 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.8 mm . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.26 -0.876 . . . . 0.0 110.945 179.985 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' HIS . . . . . 0.402 ' HA ' ' HD2' ' A' ' 2' ' ' PRO . 90.0 m-70 . . . . . 0 N--CA 1.488 1.452 0 CA-C-O 120.655 0.264 . . . . 0.0 111.173 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.402 ' HD2' ' HA ' ' A' ' 1' ' ' HIS . 43.2 Cg_endo -67.78 113.09 2.86 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.473 2.115 . . . . 0.0 112.247 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.621 ' C ' HD12 ' A' ' 3' ' ' LEU . 1.2 pp -103.65 15.61 28.42 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.712 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -87.37 -18.61 29.64 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.789 0.328 . . . . 0.0 111.186 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 -84.63 -21.51 30.27 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.176 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 60.87 84.92 0.12 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.851 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -81.8 174.97 10.82 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.931 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.449 ' C ' ' CE3' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -176.95 -94.41 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.935 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.527 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 37.2 mmt180 -69.18 -50.0 22.26 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 116.728 -0.214 . . . . 0.0 111.455 179.868 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.527 ' HD2' ' N ' ' A' ' 9' ' ' ARG . 60.4 Cg_endo -72.56 -23.53 19.81 Favored 'Trans proline' 0 C--N 1.349 0.569 0 C-N-CA 122.156 1.904 . . . . 0.0 112.639 -179.823 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 52.5 m 51.09 28.92 4.26 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.181 179.917 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.8 mm . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.24 -0.886 . . . . 0.0 110.873 -179.959 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 120.735 0.302 . . . . 0.0 111.249 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.512 ' HD2' HG21 ' A' ' 12' ' ' ILE . 45.7 Cg_endo -68.47 161.91 42.97 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.537 2.158 . . . . 0.0 112.245 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.618 ' C ' HD12 ' A' ' 3' ' ' LEU . 1.2 pp -141.13 15.78 2.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.71 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -109.84 -18.16 13.48 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.269 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 17.8 tt0 -78.51 -19.39 53.09 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.13 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.5 m-30 61.93 80.5 0.22 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.85 0.357 . . . . 0.0 110.822 -179.868 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -61.21 175.29 0.56 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.074 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.444 ' C ' ' CE3' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -176.92 -94.51 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 179.934 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.526 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 37.3 mmt180 -66.85 -50.55 43.08 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 116.724 -0.217 . . . . 0.0 111.447 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.526 ' HD2' ' N ' ' A' ' 9' ' ' ARG . 59.2 Cg_endo -71.88 -26.16 19.15 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.161 1.907 . . . . 0.0 112.636 -179.789 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 53.5 m 50.78 96.72 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.157 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.512 HG21 ' HD2' ' A' ' 2' ' ' PRO . 48.7 mm . . . . . 0 C--O 1.25 1.091 0 CA-C-O 118.285 -0.864 . . . . 0.0 110.903 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 . . . . . 0 N--CA 1.487 1.386 0 CA-C-O 120.708 0.29 . . . . 0.0 111.179 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_endo -80.79 53.97 5.02 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.652 2.235 . . . . 0.0 112.589 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.721 HD12 ' N ' ' A' ' 4' ' ' LYS . 1.2 pp -88.0 -11.05 48.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.564 179.793 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.721 ' N ' HD12 ' A' ' 3' ' ' LEU . 87.4 tttt -112.63 -18.94 12.24 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.175 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -73.19 -20.47 60.88 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.094 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 62.21 83.29 0.16 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.886 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -68.77 -175.59 0.71 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.894 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.465 ' CZ2' ' CZ ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -141.39 -93.05 0.14 Allowed 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 179.927 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.483 ' N ' ' CD ' ' A' ' 10' ' ' PRO . 37.5 mmt180 -78.24 -45.79 2.15 Favored Pre-proline 0 C--N 1.326 -0.414 0 CA-C-N 116.677 -0.238 . . . . 0.0 111.392 179.523 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.483 ' CD ' ' N ' ' A' ' 9' ' ' ARG . 84.5 Cg_endo -83.94 -164.32 0.25 Allowed 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.458 2.105 . . . . 0.0 112.3 -179.898 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 52.9 m 63.01 87.98 0.1 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.862 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.8 mm . . . . . 0 C--O 1.248 0.995 0 CA-C-O 118.18 -0.914 . . . . 0.0 110.85 179.855 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 89.9 m-70 . . . . . 0 N--CA 1.486 1.356 0 CA-C-O 120.769 0.319 . . . . 0.0 111.135 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -75.27 80.02 2.59 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.525 2.15 . . . . 0.0 112.356 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.732 HD12 ' N ' ' A' ' 4' ' ' LYS . 1.2 pp -95.56 -12.03 26.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.552 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.732 ' N ' HD12 ' A' ' 3' ' ' LEU . 87.4 tttt -97.09 78.2 2.76 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.785 0.326 . . . . 0.0 110.756 179.906 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 179.84 -29.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.316 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 66.98 82.9 0.17 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.831 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -63.56 175.33 1.08 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.008 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.453 ' CZ2' ' CZ ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -139.29 -95.75 0.17 Allowed 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 179.942 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.502 ' HB2' ' HD3' ' A' ' 10' ' ' PRO . 37.3 mmt180 -71.41 -48.99 12.25 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.885 -0.143 . . . . 0.0 111.315 179.704 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.502 ' HD3' ' HB2' ' A' ' 9' ' ' ARG . 79.4 Cg_endo -77.73 90.78 1.23 Allowed 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 122.284 1.989 . . . . 0.0 112.373 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 53.2 m -60.48 86.86 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.884 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.8 mm . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.205 -0.902 . . . . 0.0 110.919 179.999 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 . . . . . 0 N--CA 1.486 1.335 0 CA-C-O 120.624 0.249 . . . . 0.0 111.156 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.446 ' HG3' ' CD2' ' A' ' 7' ' ' TRP . 46.3 Cg_exo -54.9 144.06 68.98 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.455 2.103 . . . . 0.0 112.262 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.64 ' C ' HD12 ' A' ' 3' ' ' LEU . 1.2 pp -133.37 6.48 3.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.817 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.404 ' HB2' ' O ' ' A' ' 3' ' ' LEU . 87.4 tttt 178.47 -32.03 0.01 OUTLIER 'General case' 0 C--O 1.231 0.099 0 CA-C-O 120.965 0.412 . . . . 0.0 111.288 179.854 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 -83.9 -31.41 25.7 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.196 -179.678 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.431 ' HA ' ' HB3' ' A' ' 2' ' ' PRO . 6.6 m-30 56.0 74.96 0.36 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.858 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.446 ' CD2' ' HG3' ' A' ' 2' ' ' PRO . 1.8 p90 -83.34 155.48 23.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.944 -179.773 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.456 ' C ' ' CE3' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -111.14 -97.23 0.41 Allowed 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 179.954 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.512 ' N ' ' CD ' ' A' ' 10' ' ' PRO . 37.3 mmt180 -58.96 -44.51 98.99 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 120.414 0.15 . . . . 0.0 111.265 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.512 ' CD ' ' N ' ' A' ' 9' ' ' ARG . 37.4 Cg_exo -57.51 -164.44 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 122.349 2.033 . . . . 0.0 112.133 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.591 ' O ' HD13 ' A' ' 12' ' ' ILE . 53.2 m -164.07 31.16 0.08 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.883 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.591 HD13 ' O ' ' A' ' 11' ' ' SER . 48.8 mm . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.267 -0.873 . . . . 0.0 110.887 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' HIS . . . . . 0.499 ' HB2' ' HD3' ' A' ' 2' ' ' PRO . 90.1 m-70 . . . . . 0 N--CA 1.489 1.482 0 N-CA-C 111.927 0.343 . . . . 0.0 111.927 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.499 ' HD3' ' HB2' ' A' ' 1' ' ' HIS . 97.5 Cg_endo -79.78 81.46 2.76 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 122.17 1.913 . . . . 0.0 112.371 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.62 ' C ' HD12 ' A' ' 3' ' ' LEU . 1.2 pp -112.29 15.36 20.4 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.678 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -95.87 -17.8 20.83 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.216 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -103.8 -15.32 15.74 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.247 -179.852 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 62.54 81.62 0.2 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.86 0.362 . . . . 0.0 110.779 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -59.46 162.99 4.37 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.079 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.455 ' C ' ' CE3' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -124.53 -95.58 0.46 Allowed 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 179.84 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.504 ' HB2' ' HD3' ' A' ' 10' ' ' PRO . 37.3 mmt180 -62.59 -49.29 83.77 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-N 116.874 -0.148 . . . . 0.0 111.191 179.683 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.504 ' HD3' ' HB2' ' A' ' 9' ' ' ARG . 76.3 Cg_endo -77.26 88.84 1.37 Allowed 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 122.238 1.958 . . . . 0.0 112.353 -179.96 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 52.3 m -76.57 -18.96 58.38 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.224 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.448 HG22 ' O ' ' A' ' 12' ' ' ILE . 48.8 mm . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.262 -0.875 . . . . 0.0 110.893 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' HIS . . . . . 0.519 ' HB2' ' HD3' ' A' ' 2' ' ' PRO . 90.0 m-70 . . . . . 0 N--CA 1.49 1.529 0 N-CA-C 111.852 0.315 . . . . 0.0 111.852 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.519 ' HD3' ' HB2' ' A' ' 1' ' ' HIS . 98.7 Cg_endo -79.83 83.31 2.27 Favored 'Trans proline' 0 C--N 1.349 0.565 0 C-N-CA 122.126 1.884 . . . . 0.0 112.364 -179.827 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.684 HD12 ' N ' ' A' ' 4' ' ' LYS . 1.2 pp -79.79 -9.66 59.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.613 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.684 ' N ' HD12 ' A' ' 3' ' ' LEU . 87.3 tttt -78.56 -18.75 54.2 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.758 0.313 . . . . 0.0 111.182 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 17.7 tt0 -76.49 -19.72 57.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.154 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.5 m-30 62.17 73.63 0.46 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.852 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -74.47 165.28 25.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.881 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.458 ' C ' ' CE3' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -159.48 -98.26 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 -179.957 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.499 ' HB2' ' HD3' ' A' ' 10' ' ' PRO . 37.3 mmt180 -58.38 -46.57 99.62 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 120.402 0.144 . . . . 0.0 111.281 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.499 ' HD3' ' HB2' ' A' ' 9' ' ' ARG . 95.9 Cg_endo -85.2 -166.62 0.35 Allowed 'Trans proline' 0 N--CA 1.459 -0.504 0 C-N-CA 122.495 2.13 . . . . 0.0 112.305 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 53.2 m -165.65 32.05 0.05 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.862 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.487 HG22 ' O ' ' A' ' 12' ' ' ILE . 48.7 mm . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.222 -0.894 . . . . 0.0 110.894 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 . . . . . 0 N--CA 1.487 1.417 0 CA-C-O 120.676 0.274 . . . . 0.0 111.242 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -52.1 125.72 18.15 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.571 2.18 . . . . 0.0 112.25 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.638 ' C ' HD12 ' A' ' 3' ' ' LEU . 1.2 pp -125.01 1.57 7.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.717 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.5 ' N ' HD12 ' A' ' 3' ' ' LEU . 87.4 tttt -112.48 -18.5 12.41 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.768 0.318 . . . . 0.0 111.278 -179.916 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 -98.7 -20.29 17.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.098 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.51 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 6.4 m-30 62.61 18.1 10.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.207 179.935 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.51 ' CD1' ' O ' ' A' ' 6' ' ' TYR . 1.9 p90 42.21 -167.13 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.537 179.973 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.465 ' C ' ' CE3' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -170.43 -99.51 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 -179.917 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.501 ' N ' ' CD ' ' A' ' 10' ' ' PRO . 37.3 mmt180 -66.14 -44.76 60.83 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 120.385 0.136 . . . . 0.0 111.19 179.819 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.501 ' CD ' ' N ' ' A' ' 9' ' ' ARG . 12.8 Cg_exo -70.09 -162.28 0.09 OUTLIER 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 122.478 2.118 . . . . 0.0 112.257 -179.903 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 52.6 m -164.84 31.92 0.06 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.84 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.8 mm . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.213 -0.899 . . . . 0.0 110.861 -179.958 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 . . . . . 0 N--CA 1.485 1.324 0 CA-C-O 120.779 0.323 . . . . 0.0 111.193 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -71.81 134.62 24.15 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.544 2.163 . . . . 0.0 112.302 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.669 ' C ' HD12 ' A' ' 3' ' ' LEU . 1.1 pp -90.19 2.29 55.53 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.625 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.5 ' N ' HD12 ' A' ' 3' ' ' LEU . 87.4 tttt -90.41 -16.71 28.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.825 0.345 . . . . 0.0 111.001 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -143.15 106.4 4.56 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.856 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.535 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 7.1 m-30 -86.51 9.72 17.47 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.519 179.775 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.535 ' CD1' ' O ' ' A' ' 6' ' ' TYR . 1.9 p90 44.2 -170.33 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.896 0.379 . . . . 0.0 111.558 179.89 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.458 ' C ' ' CE3' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -143.91 -96.7 0.11 Allowed 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 -179.891 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.52 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 37.4 mmt180 -62.75 -50.16 79.08 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-N 116.882 -0.145 . . . . 0.0 111.3 179.833 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.52 ' HD2' ' N ' ' A' ' 9' ' ' ARG . 67.0 Cg_endo -73.91 87.28 1.17 Allowed 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.258 1.972 . . . . 0.0 112.296 179.953 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 52.6 m -86.6 -18.46 31.37 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.239 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.8 mm . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.248 -0.882 . . . . 0.0 110.907 -179.959 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 . . . . . 0 N--CA 1.486 1.334 0 CA-C-O 120.696 0.284 . . . . 0.0 111.164 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -70.3 103.34 1.24 Allowed 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.577 2.185 . . . . 0.0 112.311 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.615 ' C ' HD12 ' A' ' 3' ' ' LEU . 1.2 pp -100.02 16.98 22.2 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.524 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -105.51 -16.77 14.63 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.306 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 -91.81 -20.21 21.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.299 -179.833 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 60.17 75.99 0.38 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.734 -179.856 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -73.05 -176.17 2.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.974 -179.858 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.534 ' CH2' ' CZ ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -158.34 -96.61 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 179.745 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.534 ' CZ ' ' CH2' ' A' ' 8' ' ' TRP . 38.1 mmt180 -92.31 -48.59 0.31 Allowed Pre-proline 0 C--N 1.33 -0.242 0 N-CA-C 111.496 0.184 . . . . 0.0 111.496 178.521 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.516 ' HD3' ' HB2' ' A' ' 9' ' ' ARG . 93.4 Cg_endo -85.47 90.73 0.72 Allowed 'Trans proline' 0 C--N 1.349 0.574 0 C-N-CA 122.436 2.091 . . . . 0.0 112.424 -179.908 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 53.2 m -79.2 66.74 4.73 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.838 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.9 mm . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.254 -0.879 . . . . 0.0 110.938 179.998 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 . . . . . 0 N--CA 1.487 1.411 0 CA-C-O 120.693 0.282 . . . . 0.0 111.22 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -75.65 97.36 1.1 Allowed 'Trans proline' 0 C--N 1.343 0.264 0 C-N-CA 122.657 2.238 . . . . 0.0 112.36 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.819 HD12 ' N ' ' A' ' 4' ' ' LYS . 1.2 pp -116.6 -17.24 10.63 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.818 -179.944 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.819 ' N ' HD12 ' A' ' 3' ' ' LEU . 87.4 tttt -137.09 -14.56 1.55 Allowed 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -179.757 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 -101.69 -30.33 11.39 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.897 0.38 . . . . 0.0 111.114 -179.778 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.518 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 6.6 m-30 55.4 33.13 20.22 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.988 179.98 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.518 ' CD1' ' O ' ' A' ' 6' ' ' TYR . 1.9 p90 43.37 -169.05 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.51 -179.931 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.454 ' C ' ' CE3' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -150.3 -95.9 0.07 Allowed 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 -179.903 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.498 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 37.3 mmt180 -71.9 -49.67 10.22 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.879 -0.146 . . . . 0.0 111.202 179.581 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.498 ' HD2' ' N ' ' A' ' 9' ' ' ARG . 71.8 Cg_endo -76.43 83.74 1.99 Allowed 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 122.281 1.988 . . . . 0.0 112.42 -179.972 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 53.4 m -103.65 138.45 40.3 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.918 -179.921 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.8 mm . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.276 -0.869 . . . . 0.0 110.823 -180.0 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 . . . . . 0 N--CA 1.486 1.367 0 CA-C-O 120.621 0.248 . . . . 0.0 111.201 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_exo -47.74 159.99 0.49 Allowed 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.606 2.204 . . . . 0.0 112.343 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.644 ' C ' HD12 ' A' ' 3' ' ' LEU . 1.2 pp -134.3 9.68 3.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.781 -179.926 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -127.7 -13.3 5.34 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 111.742 0.275 . . . . 0.0 111.742 -179.78 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 17.8 tt0 -70.21 -31.33 68.72 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.91 0.386 . . . . 0.0 111.138 -179.822 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.9 m-30 54.67 80.52 0.12 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.041 179.91 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -104.27 161.75 13.78 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.665 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.537 ' CH2' ' CZ ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -112.31 -97.84 0.42 Allowed 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 -179.962 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.537 ' CZ ' ' CH2' ' A' ' 8' ' ' TRP . 38.1 mmt180 -88.61 -48.09 0.43 Allowed Pre-proline 0 CA--C 1.532 0.268 0 CA-C-N 116.915 -0.13 . . . . 0.0 111.292 178.709 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.495 ' HD3' ' HB2' ' A' ' 9' ' ' ARG . 91.0 Cg_endo -83.39 97.43 0.8 Allowed 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 122.391 2.061 . . . . 0.0 112.509 -179.718 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 52.8 m -80.01 141.35 36.02 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.8 179.878 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.7 mm . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.259 -0.877 . . . . 0.0 110.978 -179.94 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' HIS . . . . . 0.504 ' HB2' ' HD3' ' A' ' 2' ' ' PRO . 90.0 m-70 . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 111.947 0.351 . . . . 0.0 111.947 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.504 ' HD3' ' HB2' ' A' ' 1' ' ' HIS . 95.0 Cg_endo -80.46 57.8 6.69 Favored 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 122.182 1.921 . . . . 0.0 112.361 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.633 ' C ' HD12 ' A' ' 3' ' ' LEU . 1.2 pp -110.1 12.94 23.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.645 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -76.75 -18.75 58.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.765 0.317 . . . . 0.0 111.137 179.892 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.429 ' HG2' ' O ' ' A' ' 5' ' ' GLN . 41.4 tt0 -112.03 -4.2 14.55 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.269 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 65.52 91.84 0.08 Allowed 'General case' 0 C--O 1.231 0.116 0 CA-C-O 120.838 0.351 . . . . 0.0 110.812 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -65.8 -177.88 0.51 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.01 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.46 ' C ' ' CE3' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -171.29 -98.12 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 179.954 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.54 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 37.3 mmt180 -62.88 -55.36 38.77 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 120.354 0.121 . . . . 0.0 111.204 179.828 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.54 ' HD2' ' N ' ' A' ' 9' ' ' ARG . 19.7 Cg_endo -58.89 -76.71 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 122.267 1.978 . . . . 0.0 112.346 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 53.4 m 61.25 170.55 0.1 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.88 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.8 mm . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.846 179.978 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 89.9 m-70 . . . . . 0 N--CA 1.486 1.371 0 CA-C-O 120.641 0.258 . . . . 0.0 111.123 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_endo -78.5 56.93 6.07 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.58 2.187 . . . . 0.0 112.43 -179.879 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.611 ' C ' HD12 ' A' ' 3' ' ' LEU . 1.2 pp -113.45 16.45 18.85 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.558 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -74.57 -19.67 60.24 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.11 179.874 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.425 ' O ' ' HB2' ' A' ' 6' ' ' TYR . 41.5 tt0 -116.89 -4.6 11.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.084 179.862 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.483 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 6.2 m-30 70.32 8.32 6.58 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.503 -179.981 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.483 ' CD1' ' O ' ' A' ' 6' ' ' TYR . 1.9 p90 40.66 -165.0 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.819 0.342 . . . . 0.0 111.611 179.66 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.454 ' CZ2' ' CZ ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -170.5 -95.56 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 -179.991 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.495 ' HB2' ' HD3' ' A' ' 10' ' ' PRO . 37.4 mmt180 -72.84 -49.06 8.05 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 116.849 -0.159 . . . . 0.0 111.173 179.548 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.495 ' HD3' ' HB2' ' A' ' 9' ' ' ARG . 91.3 Cg_endo -78.48 81.69 2.68 Favored 'Trans proline' 0 C--N 1.349 0.557 0 C-N-CA 122.223 1.949 . . . . 0.0 112.396 -179.998 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 52.8 m -76.0 112.87 12.88 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.814 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.493 ' OXT' HG22 ' A' ' 12' ' ' ILE . 48.8 mm . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.203 -0.903 . . . . 0.0 110.952 -179.91 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 . . . . . 0 N--CA 1.485 1.323 0 CA-C-O 120.661 0.267 . . . . 0.0 111.261 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -67.99 124.67 12.08 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.606 2.204 . . . . 0.0 112.237 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.719 HD12 ' N ' ' A' ' 4' ' ' LYS . 1.2 pp -74.0 -10.53 59.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.646 -179.949 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.719 ' N ' HD12 ' A' ' 3' ' ' LEU . 87.4 tttt -82.5 -17.49 44.93 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.702 0.287 . . . . 0.0 111.273 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 -97.42 93.73 6.64 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.953 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.539 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 6.5 m-30 -71.14 -12.58 61.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.207 179.841 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.539 ' CD1' ' O ' ' A' ' 6' ' ' TYR . 1.9 p90 44.38 -170.69 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 120.998 0.428 . . . . 0.0 111.512 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' TRP . . . . . 0.455 ' C ' ' CE3' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -154.99 -94.91 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 -179.841 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.527 ' HB2' ' HD3' ' A' ' 10' ' ' PRO . 37.3 mmt180 -60.0 -47.07 97.92 Favored Pre-proline 0 C--N 1.328 -0.37 0 CA-C-N 116.905 -0.134 . . . . 0.0 111.129 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.527 ' HD3' ' HB2' ' A' ' 9' ' ' ARG . 2.1 Cg_endo -83.02 112.63 2.05 Favored 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.864 2.376 . . . . 0.0 112.039 -179.866 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 52.5 m -94.94 -23.06 17.58 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.098 -179.964 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.7 mm . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.24 -0.886 . . . . 0.0 110.82 179.957 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 . . . . . 0 N--CA 1.487 1.387 0 CA-C-O 120.736 0.303 . . . . 0.0 111.209 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -52.66 130.46 36.99 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 122.527 2.151 . . . . 0.0 112.259 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.63 HD12 ' C ' ' A' ' 3' ' ' LEU . 1.2 pp -131.52 13.09 4.98 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.654 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -113.63 -16.83 12.28 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.353 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 -80.66 -24.81 38.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.098 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.6 m-30 58.62 88.8 0.06 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.839 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -80.85 171.55 14.86 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.904 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.455 ' CE3' ' C ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -132.36 -99.74 0.28 Allowed 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 179.99 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.527 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 37.3 mmt180 -64.84 -51.02 60.22 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 120.426 0.155 . . . . 0.0 111.3 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.527 ' HD2' ' N ' ' A' ' 9' ' ' ARG . 59.7 Cg_endo . . . . . 0 C--N 1.348 0.534 0 C-N-CA 122.221 1.947 . . . . 0.0 112.242 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.2 m-70 . . . . . 0 N--CA 1.488 1.466 0 CA-C-O 120.787 0.327 . . . . 0.0 111.255 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -70.12 97.8 0.69 Allowed 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.588 2.192 . . . . 0.0 112.291 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.738 HD12 ' N ' ' A' ' 4' ' ' LYS . 1.2 pp -73.75 -11.49 60.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.598 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.738 ' N ' HD12 ' A' ' 3' ' ' LEU . 87.4 tttt -96.1 -19.39 19.45 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.75 0.31 . . . . 0.0 111.32 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -67.14 -23.12 65.76 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.063 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.6 m-30 60.15 74.58 0.44 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.781 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -60.59 177.01 0.32 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.927 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.452 ' CE3' ' C ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -137.85 -95.52 0.2 Allowed 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 179.841 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.509 ' HB2' ' HD3' ' A' ' 10' ' ' PRO . 37.3 mmt180 -58.13 -48.86 96.3 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.857 -0.156 . . . . 0.0 111.255 179.792 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.509 ' HD3' ' HB2' ' A' ' 9' ' ' ARG . 91.2 Cg_endo . . . . . 0 C--N 1.348 0.52 0 C-N-CA 122.302 2.001 . . . . 0.0 112.343 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.672 0.272 . . . . 0.0 111.219 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.43 73.58 1.21 Allowed 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.615 2.21 . . . . 0.0 112.333 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.629 HD12 ' C ' ' A' ' 3' ' ' LEU . 1.2 pp -104.3 11.37 34.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.582 -179.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -93.9 -18.91 21.46 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.743 0.306 . . . . 0.0 111.168 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -107.24 -12.35 15.39 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.282 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 63.93 88.25 0.1 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.879 0.371 . . . . 0.0 110.872 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -65.6 -176.35 0.34 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.926 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.464 ' CZ2' ' CZ ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -175.88 -95.67 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.503 -0.555 . . . . 0.0 109.503 179.904 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.493 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 37.4 mmt180 -73.13 -49.65 7.04 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 116.925 -0.125 . . . . 0.0 111.303 179.657 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.493 ' HD2' ' N ' ' A' ' 9' ' ' ARG . 72.9 Cg_endo . . . . . 0 C--N 1.348 0.533 0 C-N-CA 122.122 1.881 . . . . 0.0 112.65 -179.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 . . . . . 0 N--CA 1.486 1.335 0 CA-C-O 120.763 0.316 . . . . 0.0 111.237 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -71.17 115.38 4.25 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.62 2.213 . . . . 0.0 112.237 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.621 HD12 ' C ' ' A' ' 3' ' ' LEU . 1.2 pp -94.7 12.76 26.65 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.573 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -111.69 -17.87 12.89 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.69 0.281 . . . . 0.0 111.29 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -68.75 -27.71 66.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.935 0.397 . . . . 0.0 111.081 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.6 m-30 57.09 63.65 1.85 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.889 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -61.47 154.81 23.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.968 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.458 ' CE3' ' C ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -149.69 -97.16 0.07 Allowed 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.681 179.967 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.522 ' HB2' ' HD3' ' A' ' 10' ' ' PRO . 37.3 mmt180 -57.31 -47.67 98.63 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 120.379 0.133 . . . . 0.0 111.261 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.522 ' HD3' ' HB2' ' A' ' 9' ' ' ARG . 91.1 Cg_endo . . . . . 0 C--N 1.347 0.493 0 C-N-CA 122.414 2.076 . . . . 0.0 112.109 179.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' HIS . . . . . 0.402 ' HA ' ' HD2' ' A' ' 2' ' ' PRO . 90.0 m-70 . . . . . 0 N--CA 1.488 1.452 0 CA-C-O 120.655 0.264 . . . . 0.0 111.173 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . 0.402 ' HD2' ' HA ' ' A' ' 1' ' ' HIS . 43.2 Cg_endo -67.78 113.09 2.86 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.473 2.115 . . . . 0.0 112.247 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.621 HD12 ' C ' ' A' ' 3' ' ' LEU . 1.2 pp -103.65 15.61 28.42 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.712 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -87.37 -18.61 29.64 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.789 0.328 . . . . 0.0 111.186 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 -84.63 -21.51 30.27 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.176 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 60.87 84.92 0.12 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.851 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -81.8 174.97 10.82 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.931 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.449 ' CE3' ' C ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -176.95 -94.41 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.935 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.527 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 37.2 mmt180 -69.18 -50.0 22.26 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 116.728 -0.214 . . . . 0.0 111.455 179.868 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.527 ' HD2' ' N ' ' A' ' 9' ' ' ARG . 60.4 Cg_endo . . . . . 0 C--N 1.349 0.569 0 C-N-CA 122.156 1.904 . . . . 0.0 112.639 -179.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 120.735 0.302 . . . . 0.0 111.249 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -68.47 161.91 42.97 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.537 2.158 . . . . 0.0 112.245 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.618 HD12 ' C ' ' A' ' 3' ' ' LEU . 1.2 pp -141.13 15.78 2.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.71 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -109.84 -18.16 13.48 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.269 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -78.51 -19.39 53.09 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.13 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.5 m-30 61.93 80.5 0.22 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.85 0.357 . . . . 0.0 110.822 -179.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -61.21 175.29 0.56 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.074 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.444 ' CE3' ' C ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -176.92 -94.51 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 179.934 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.526 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 37.3 mmt180 -66.85 -50.55 43.08 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 116.724 -0.217 . . . . 0.0 111.447 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.526 ' HD2' ' N ' ' A' ' 9' ' ' ARG . 59.2 Cg_endo . . . . . 0 C--N 1.347 0.47 0 C-N-CA 122.161 1.907 . . . . 0.0 112.636 -179.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 . . . . . 0 N--CA 1.487 1.386 0 CA-C-O 120.708 0.29 . . . . 0.0 111.179 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_endo -80.79 53.97 5.02 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.652 2.235 . . . . 0.0 112.589 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.721 HD12 ' N ' ' A' ' 4' ' ' LYS . 1.2 pp -88.0 -11.05 48.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.564 179.793 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.721 ' N ' HD12 ' A' ' 3' ' ' LEU . 87.4 tttt -112.63 -18.94 12.24 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.175 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -73.19 -20.47 60.88 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.094 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 62.21 83.29 0.16 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.886 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -68.77 -175.59 0.71 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.894 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.465 ' CZ2' ' CZ ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -141.39 -93.05 0.14 Allowed 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 179.927 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.483 ' N ' ' CD ' ' A' ' 10' ' ' PRO . 37.5 mmt180 -78.24 -45.79 2.15 Favored Pre-proline 0 C--N 1.326 -0.414 0 CA-C-N 116.677 -0.238 . . . . 0.0 111.392 179.523 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.483 ' CD ' ' N ' ' A' ' 9' ' ' ARG . 84.5 Cg_endo . . . . . 0 C--N 1.347 0.461 0 C-N-CA 122.458 2.105 . . . . 0.0 112.3 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 89.9 m-70 . . . . . 0 N--CA 1.486 1.356 0 CA-C-O 120.769 0.319 . . . . 0.0 111.135 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -75.27 80.02 2.59 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.525 2.15 . . . . 0.0 112.356 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.732 HD12 ' N ' ' A' ' 4' ' ' LYS . 1.2 pp -95.56 -12.03 26.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.552 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.732 ' N ' HD12 ' A' ' 3' ' ' LEU . 87.4 tttt -97.09 78.2 2.76 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.785 0.326 . . . . 0.0 110.756 179.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 179.84 -29.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.316 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 66.98 82.9 0.17 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.831 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -63.56 175.33 1.08 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.008 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.453 ' CZ2' ' CZ ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -139.29 -95.75 0.17 Allowed 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 179.942 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.502 ' HB2' ' HD3' ' A' ' 10' ' ' PRO . 37.3 mmt180 -71.41 -48.99 12.25 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.885 -0.143 . . . . 0.0 111.315 179.704 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.502 ' HD3' ' HB2' ' A' ' 9' ' ' ARG . 79.4 Cg_endo . . . . . 0 C--N 1.349 0.563 0 C-N-CA 122.284 1.989 . . . . 0.0 112.373 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 . . . . . 0 N--CA 1.486 1.335 0 CA-C-O 120.624 0.249 . . . . 0.0 111.156 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . 0.446 ' HG3' ' CD2' ' A' ' 7' ' ' TRP . 46.3 Cg_exo -54.9 144.06 68.98 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.455 2.103 . . . . 0.0 112.262 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.64 HD12 ' C ' ' A' ' 3' ' ' LEU . 1.2 pp -133.37 6.48 3.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.817 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.404 ' HB2' ' O ' ' A' ' 3' ' ' LEU . 87.4 tttt 178.47 -32.03 0.01 OUTLIER 'General case' 0 C--O 1.231 0.099 0 CA-C-O 120.965 0.412 . . . . 0.0 111.288 179.854 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 -83.9 -31.41 25.7 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.196 -179.678 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.431 ' HA ' ' HB3' ' A' ' 2' ' ' PRO . 6.6 m-30 56.0 74.96 0.36 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.858 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.446 ' CD2' ' HG3' ' A' ' 2' ' ' PRO . 1.8 p90 -83.34 155.48 23.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.944 -179.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.456 ' CE3' ' C ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -111.14 -97.23 0.41 Allowed 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 179.954 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.512 ' N ' ' CD ' ' A' ' 10' ' ' PRO . 37.3 mmt180 -58.96 -44.51 98.99 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 120.414 0.15 . . . . 0.0 111.265 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.512 ' CD ' ' N ' ' A' ' 9' ' ' ARG . 37.4 Cg_exo . . . . . 0 C--N 1.348 0.546 0 C-N-CA 122.349 2.033 . . . . 0.0 112.133 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 1' ' ' HIS . . . . . 0.499 ' HB2' ' HD3' ' A' ' 2' ' ' PRO . 90.1 m-70 . . . . . 0 N--CA 1.489 1.482 0 N-CA-C 111.927 0.343 . . . . 0.0 111.927 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . 0.499 ' HD3' ' HB2' ' A' ' 1' ' ' HIS . 97.5 Cg_endo -79.78 81.46 2.76 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 122.17 1.913 . . . . 0.0 112.371 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.62 HD12 ' C ' ' A' ' 3' ' ' LEU . 1.2 pp -112.29 15.36 20.4 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.678 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -95.87 -17.8 20.83 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.216 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -103.8 -15.32 15.74 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.247 -179.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 62.54 81.62 0.2 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.86 0.362 . . . . 0.0 110.779 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -59.46 162.99 4.37 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.079 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.455 ' CE3' ' C ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -124.53 -95.58 0.46 Allowed 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 179.84 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.504 ' HB2' ' HD3' ' A' ' 10' ' ' PRO . 37.3 mmt180 -62.59 -49.29 83.77 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-N 116.874 -0.148 . . . . 0.0 111.191 179.683 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.504 ' HD3' ' HB2' ' A' ' 9' ' ' ARG . 76.3 Cg_endo . . . . . 0 C--N 1.349 0.576 0 C-N-CA 122.238 1.958 . . . . 0.0 112.353 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 1' ' ' HIS . . . . . 0.519 ' HB2' ' HD3' ' A' ' 2' ' ' PRO . 90.0 m-70 . . . . . 0 N--CA 1.49 1.529 0 N-CA-C 111.852 0.315 . . . . 0.0 111.852 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . 0.519 ' HD3' ' HB2' ' A' ' 1' ' ' HIS . 98.7 Cg_endo -79.83 83.31 2.27 Favored 'Trans proline' 0 C--N 1.349 0.565 0 C-N-CA 122.126 1.884 . . . . 0.0 112.364 -179.827 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.684 HD12 ' N ' ' A' ' 4' ' ' LYS . 1.2 pp -79.79 -9.66 59.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.613 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.684 ' N ' HD12 ' A' ' 3' ' ' LEU . 87.3 tttt -78.56 -18.75 54.2 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.758 0.313 . . . . 0.0 111.182 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -76.49 -19.72 57.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.154 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.5 m-30 62.17 73.63 0.46 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.852 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -74.47 165.28 25.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.881 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.458 ' CE3' ' C ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -159.48 -98.26 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 -179.957 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.499 ' HB2' ' HD3' ' A' ' 10' ' ' PRO . 37.3 mmt180 -58.38 -46.57 99.62 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 120.402 0.144 . . . . 0.0 111.281 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.499 ' HD3' ' HB2' ' A' ' 9' ' ' ARG . 95.9 Cg_endo . . . . . 0 N--CA 1.459 -0.504 0 C-N-CA 122.495 2.13 . . . . 0.0 112.305 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 . . . . . 0 N--CA 1.487 1.417 0 CA-C-O 120.676 0.274 . . . . 0.0 111.242 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -52.1 125.72 18.15 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.571 2.18 . . . . 0.0 112.25 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.638 HD12 ' C ' ' A' ' 3' ' ' LEU . 1.2 pp -125.01 1.57 7.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.717 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.5 ' N ' HD12 ' A' ' 3' ' ' LEU . 87.4 tttt -112.48 -18.5 12.41 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.768 0.318 . . . . 0.0 111.278 -179.916 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 -98.7 -20.29 17.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.098 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.51 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 6.4 m-30 62.61 18.1 10.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.207 179.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.51 ' CD1' ' O ' ' A' ' 6' ' ' TYR . 1.9 p90 42.21 -167.13 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.537 179.973 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.465 ' CE3' ' C ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -170.43 -99.51 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 -179.917 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.501 ' N ' ' CD ' ' A' ' 10' ' ' PRO . 37.3 mmt180 -66.14 -44.76 60.83 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 120.385 0.136 . . . . 0.0 111.19 179.819 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.501 ' CD ' ' N ' ' A' ' 9' ' ' ARG . 12.8 Cg_exo . . . . . 0 C--N 1.348 0.52 0 C-N-CA 122.478 2.118 . . . . 0.0 112.257 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 . . . . . 0 N--CA 1.485 1.324 0 CA-C-O 120.779 0.323 . . . . 0.0 111.193 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -71.81 134.62 24.15 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.544 2.163 . . . . 0.0 112.302 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.669 HD12 ' C ' ' A' ' 3' ' ' LEU . 1.1 pp -90.19 2.29 55.53 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.625 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.5 ' N ' HD12 ' A' ' 3' ' ' LEU . 87.4 tttt -90.41 -16.71 28.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.825 0.345 . . . . 0.0 111.001 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -143.15 106.4 4.56 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.856 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.535 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 7.1 m-30 -86.51 9.72 17.47 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.519 179.775 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.535 ' CD1' ' O ' ' A' ' 6' ' ' TYR . 1.9 p90 44.2 -170.33 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.896 0.379 . . . . 0.0 111.558 179.89 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.458 ' CE3' ' C ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -143.91 -96.7 0.11 Allowed 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 -179.891 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.52 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 37.4 mmt180 -62.75 -50.16 79.08 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-N 116.882 -0.145 . . . . 0.0 111.3 179.833 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.52 ' HD2' ' N ' ' A' ' 9' ' ' ARG . 67.0 Cg_endo . . . . . 0 C--N 1.348 0.533 0 C-N-CA 122.258 1.972 . . . . 0.0 112.296 179.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 . . . . . 0 N--CA 1.486 1.334 0 CA-C-O 120.696 0.284 . . . . 0.0 111.164 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -70.3 103.34 1.24 Allowed 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.577 2.185 . . . . 0.0 112.311 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.615 HD12 ' C ' ' A' ' 3' ' ' LEU . 1.2 pp -100.02 16.98 22.2 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.524 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -105.51 -16.77 14.63 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.306 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 -91.81 -20.21 21.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.299 -179.833 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 60.17 75.99 0.38 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.734 -179.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -73.05 -176.17 2.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.974 -179.858 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.534 ' CH2' ' CZ ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -158.34 -96.61 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 179.745 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.534 ' CZ ' ' CH2' ' A' ' 8' ' ' TRP . 38.1 mmt180 -92.31 -48.59 0.31 Allowed Pre-proline 0 C--N 1.33 -0.242 0 N-CA-C 111.496 0.184 . . . . 0.0 111.496 178.521 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.516 ' HD3' ' HB2' ' A' ' 9' ' ' ARG . 93.4 Cg_endo . . . . . 0 C--N 1.349 0.574 0 C-N-CA 122.436 2.091 . . . . 0.0 112.424 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 . . . . . 0 N--CA 1.487 1.411 0 CA-C-O 120.693 0.282 . . . . 0.0 111.22 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -75.65 97.36 1.1 Allowed 'Trans proline' 0 C--N 1.343 0.264 0 C-N-CA 122.657 2.238 . . . . 0.0 112.36 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.819 HD12 ' N ' ' A' ' 4' ' ' LYS . 1.2 pp -116.6 -17.24 10.63 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.818 -179.944 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.819 ' N ' HD12 ' A' ' 3' ' ' LEU . 87.4 tttt -137.09 -14.56 1.55 Allowed 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -179.757 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 -101.69 -30.33 11.39 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.897 0.38 . . . . 0.0 111.114 -179.778 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.518 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 6.6 m-30 55.4 33.13 20.22 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.988 179.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.518 ' CD1' ' O ' ' A' ' 6' ' ' TYR . 1.9 p90 43.37 -169.05 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.51 -179.931 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.454 ' CE3' ' C ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -150.3 -95.9 0.07 Allowed 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 -179.903 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.498 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 37.3 mmt180 -71.9 -49.67 10.22 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.879 -0.146 . . . . 0.0 111.202 179.581 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.498 ' HD2' ' N ' ' A' ' 9' ' ' ARG . 71.8 Cg_endo . . . . . 0 C--N 1.348 0.517 0 C-N-CA 122.281 1.988 . . . . 0.0 112.42 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 . . . . . 0 N--CA 1.486 1.367 0 CA-C-O 120.621 0.248 . . . . 0.0 111.201 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_exo -47.74 159.99 0.49 Allowed 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.606 2.204 . . . . 0.0 112.343 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.644 HD12 ' C ' ' A' ' 3' ' ' LEU . 1.2 pp -134.3 9.68 3.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.781 -179.926 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -127.7 -13.3 5.34 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 111.742 0.275 . . . . 0.0 111.742 -179.78 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -70.21 -31.33 68.72 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.91 0.386 . . . . 0.0 111.138 -179.822 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.9 m-30 54.67 80.52 0.12 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.041 179.91 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -104.27 161.75 13.78 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.665 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.537 ' CH2' ' CZ ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -112.31 -97.84 0.42 Allowed 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 -179.962 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.537 ' CZ ' ' CH2' ' A' ' 8' ' ' TRP . 38.1 mmt180 -88.61 -48.09 0.43 Allowed Pre-proline 0 CA--C 1.532 0.268 0 CA-C-N 116.915 -0.13 . . . . 0.0 111.292 178.709 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.495 ' HD3' ' HB2' ' A' ' 9' ' ' ARG . 91.0 Cg_endo . . . . . 0 C--N 1.349 0.598 0 C-N-CA 122.391 2.061 . . . . 0.0 112.509 -179.718 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 1' ' ' HIS . . . . . 0.504 ' HB2' ' HD3' ' A' ' 2' ' ' PRO . 90.0 m-70 . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 111.947 0.351 . . . . 0.0 111.947 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . 0.504 ' HD3' ' HB2' ' A' ' 1' ' ' HIS . 95.0 Cg_endo -80.46 57.8 6.69 Favored 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 122.182 1.921 . . . . 0.0 112.361 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.633 HD12 ' C ' ' A' ' 3' ' ' LEU . 1.2 pp -110.1 12.94 23.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.645 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -76.75 -18.75 58.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.765 0.317 . . . . 0.0 111.137 179.892 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . 0.429 ' O ' ' HG2' ' A' ' 5' ' ' GLN . 41.4 tt0 -112.03 -4.2 14.55 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.269 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 65.52 91.84 0.08 Allowed 'General case' 0 C--O 1.231 0.116 0 CA-C-O 120.838 0.351 . . . . 0.0 110.812 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -65.8 -177.88 0.51 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.01 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.46 ' CE3' ' C ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -171.29 -98.12 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 179.954 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.54 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 37.3 mmt180 -62.88 -55.36 38.77 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 120.354 0.121 . . . . 0.0 111.204 179.828 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.54 ' HD2' ' N ' ' A' ' 9' ' ' ARG . 19.7 Cg_endo . . . . . 0 C--N 1.348 0.543 0 C-N-CA 122.267 1.978 . . . . 0.0 112.346 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 89.9 m-70 . . . . . 0 N--CA 1.486 1.371 0 CA-C-O 120.641 0.258 . . . . 0.0 111.123 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_endo -78.5 56.93 6.07 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.58 2.187 . . . . 0.0 112.43 -179.879 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.611 HD12 ' C ' ' A' ' 3' ' ' LEU . 1.2 pp -113.45 16.45 18.85 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.558 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -74.57 -19.67 60.24 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.11 179.874 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . 0.425 ' O ' ' HB2' ' A' ' 6' ' ' TYR . 41.5 tt0 -116.89 -4.6 11.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.084 179.862 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.483 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 6.2 m-30 70.32 8.32 6.58 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.503 -179.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.483 ' CD1' ' O ' ' A' ' 6' ' ' TYR . 1.9 p90 40.66 -165.0 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.819 0.342 . . . . 0.0 111.611 179.66 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.454 ' CZ2' ' CZ ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -170.5 -95.56 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 -179.991 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.495 ' HB2' ' HD3' ' A' ' 10' ' ' PRO . 37.4 mmt180 -72.84 -49.06 8.05 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 116.849 -0.159 . . . . 0.0 111.173 179.548 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.495 ' HD3' ' HB2' ' A' ' 9' ' ' ARG . 91.3 Cg_endo . . . . . 0 C--N 1.349 0.557 0 C-N-CA 122.223 1.949 . . . . 0.0 112.396 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 . . . . . 0 N--CA 1.485 1.323 0 CA-C-O 120.661 0.267 . . . . 0.0 111.261 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -67.99 124.67 12.08 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.606 2.204 . . . . 0.0 112.237 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.719 HD12 ' N ' ' A' ' 4' ' ' LYS . 1.2 pp -74.0 -10.53 59.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.646 -179.949 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.719 ' N ' HD12 ' A' ' 3' ' ' LEU . 87.4 tttt -82.5 -17.49 44.93 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.702 0.287 . . . . 0.0 111.273 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 -97.42 93.73 6.64 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.953 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.539 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 6.5 m-30 -71.14 -12.58 61.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.207 179.841 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . 0.539 ' CD1' ' O ' ' A' ' 6' ' ' TYR . 1.9 p90 44.38 -170.69 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 120.998 0.428 . . . . 0.0 111.512 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' TRP . . . . . 0.455 ' CE3' ' C ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -154.99 -94.91 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 -179.841 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.527 ' HB2' ' HD3' ' A' ' 10' ' ' PRO . 37.3 mmt180 -60.0 -47.07 97.92 Favored Pre-proline 0 C--N 1.328 -0.37 0 CA-C-N 116.905 -0.134 . . . . 0.0 111.129 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.527 ' HD3' ' HB2' ' A' ' 9' ' ' ARG . 2.1 Cg_endo . . . . . 0 C--N 1.348 0.514 0 C-N-CA 122.864 2.376 . . . . 0.0 112.039 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 . . . . . 0 N--CA 1.487 1.387 0 CA-C-O 120.736 0.303 . . . . 0.0 111.209 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -52.66 130.46 36.99 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 122.527 2.151 . . . . 0.0 112.259 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.63 HD12 ' C ' ' A' ' 3' ' ' LEU . 1.2 pp -131.52 13.09 4.98 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.654 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -113.63 -16.83 12.28 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.353 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 -80.66 -24.81 38.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.098 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.6 m-30 58.62 88.8 0.06 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.839 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -80.85 171.55 14.86 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.904 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.455 ' CE3' ' C ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -132.36 -99.74 0.28 Allowed 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 179.99 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.527 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 37.3 mmt180 -64.84 -51.02 60.22 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 120.426 0.155 . . . . 0.0 111.3 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.527 ' HD2' ' N ' ' A' ' 9' ' ' ARG . 59.7 Cg_endo -72.26 84.71 1.11 Allowed 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 122.221 1.947 . . . . 0.0 112.242 -179.898 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 52.9 m -121.47 121.52 37.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.851 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.8 mm . . . . . 0 C--O 1.251 1.139 0 CA-C-O 118.181 -0.914 . . . . 0.0 110.836 179.994 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.2 m-70 . . . . . 0 N--CA 1.488 1.466 0 CA-C-O 120.787 0.327 . . . . 0.0 111.255 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -70.12 97.8 0.69 Allowed 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.588 2.192 . . . . 0.0 112.291 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.738 HD12 ' N ' ' A' ' 4' ' ' LYS . 1.2 pp -73.75 -11.49 60.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.598 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.738 ' N ' HD12 ' A' ' 3' ' ' LEU . 87.4 tttt -96.1 -19.39 19.45 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.75 0.31 . . . . 0.0 111.32 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -67.14 -23.12 65.76 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.063 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.6 m-30 60.15 74.58 0.44 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.781 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -60.59 177.01 0.32 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.927 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.452 ' CE3' ' C ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -137.85 -95.52 0.2 Allowed 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 179.841 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.509 ' HB2' ' HD3' ' A' ' 10' ' ' PRO . 37.3 mmt180 -58.13 -48.86 96.3 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.857 -0.156 . . . . 0.0 111.255 179.792 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.509 ' HD3' ' HB2' ' A' ' 9' ' ' ARG . 91.2 Cg_endo -78.18 76.98 4.14 Favored 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 122.302 2.001 . . . . 0.0 112.343 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 52.4 m -86.54 116.67 24.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.855 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.7 mm . . . . . 0 C--O 1.25 1.086 0 CA-C-O 118.28 -0.867 . . . . 0.0 110.919 179.953 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.672 0.272 . . . . 0.0 111.219 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.43 73.58 1.21 Allowed 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.615 2.21 . . . . 0.0 112.333 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.629 HD12 ' C ' ' A' ' 3' ' ' LEU . 1.2 pp -104.3 11.37 34.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.582 -179.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -93.9 -18.91 21.46 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.743 0.306 . . . . 0.0 111.168 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -107.24 -12.35 15.39 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.282 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 63.93 88.25 0.1 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.879 0.371 . . . . 0.0 110.872 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -65.6 -176.35 0.34 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.926 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.464 ' CZ2' ' CZ ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -175.88 -95.67 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.503 -0.555 . . . . 0.0 109.503 179.904 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.493 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 37.4 mmt180 -73.13 -49.65 7.04 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 116.925 -0.125 . . . . 0.0 111.303 179.657 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.493 ' HD2' ' N ' ' A' ' 9' ' ' ARG . 72.9 Cg_endo -75.99 -13.25 19.47 Favored 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.122 1.881 . . . . 0.0 112.65 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.438 ' O ' HD13 ' A' ' 12' ' ' ILE . 52.8 m 62.19 31.11 17.74 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.97 179.913 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.438 HD13 ' O ' ' A' ' 11' ' ' SER . 48.7 mm . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.852 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 . . . . . 0 N--CA 1.486 1.335 0 CA-C-O 120.763 0.316 . . . . 0.0 111.237 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -71.17 115.38 4.25 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.62 2.213 . . . . 0.0 112.237 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.621 HD12 ' C ' ' A' ' 3' ' ' LEU . 1.2 pp -94.7 12.76 26.65 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.573 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -111.69 -17.87 12.89 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.69 0.281 . . . . 0.0 111.29 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -68.75 -27.71 66.16 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.935 0.397 . . . . 0.0 111.081 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.6 m-30 57.09 63.65 1.85 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.889 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -61.47 154.81 23.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.968 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.458 ' CE3' ' C ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -149.69 -97.16 0.07 Allowed 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.681 179.967 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.522 ' HB2' ' HD3' ' A' ' 10' ' ' PRO . 37.3 mmt180 -57.31 -47.67 98.63 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 120.379 0.133 . . . . 0.0 111.261 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.522 ' HD3' ' HB2' ' A' ' 9' ' ' ARG . 91.1 Cg_endo -83.23 -164.17 0.25 Allowed 'Trans proline' 0 C--N 1.347 0.493 0 C-N-CA 122.414 2.076 . . . . 0.0 112.109 179.833 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 52.9 m -164.67 103.82 0.81 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.883 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.8 mm . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.26 -0.876 . . . . 0.0 110.945 179.985 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . 0.402 ' HA ' ' HD2' ' A' ' 2' ' ' PRO . 90.0 m-70 . . . . . 0 N--CA 1.488 1.452 0 CA-C-O 120.655 0.264 . . . . 0.0 111.173 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.402 ' HD2' ' HA ' ' A' ' 1' ' ' HIS . 43.2 Cg_endo -67.78 113.09 2.86 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.473 2.115 . . . . 0.0 112.247 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.621 HD12 ' C ' ' A' ' 3' ' ' LEU . 1.2 pp -103.65 15.61 28.42 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.712 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -87.37 -18.61 29.64 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.789 0.328 . . . . 0.0 111.186 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 -84.63 -21.51 30.27 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.176 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 60.87 84.92 0.12 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.851 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -81.8 174.97 10.82 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.931 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.449 ' CE3' ' C ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -176.95 -94.41 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 179.935 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.527 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 37.2 mmt180 -69.18 -50.0 22.26 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 116.728 -0.214 . . . . 0.0 111.455 179.868 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.527 ' HD2' ' N ' ' A' ' 9' ' ' ARG . 60.4 Cg_endo -72.56 -23.53 19.81 Favored 'Trans proline' 0 C--N 1.349 0.569 0 C-N-CA 122.156 1.904 . . . . 0.0 112.639 -179.823 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 52.5 m 51.09 28.92 4.26 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.181 179.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.8 mm . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.24 -0.886 . . . . 0.0 110.873 -179.959 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 120.735 0.302 . . . . 0.0 111.249 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.512 ' HD2' HG21 ' A' ' 12' ' ' ILE . 45.7 Cg_endo -68.47 161.91 42.97 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.537 2.158 . . . . 0.0 112.245 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.618 HD12 ' C ' ' A' ' 3' ' ' LEU . 1.2 pp -141.13 15.78 2.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.71 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -109.84 -18.16 13.48 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.269 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -78.51 -19.39 53.09 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.13 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.5 m-30 61.93 80.5 0.22 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.85 0.357 . . . . 0.0 110.822 -179.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -61.21 175.29 0.56 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.074 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.444 ' CE3' ' C ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -176.92 -94.51 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 179.934 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.526 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 37.3 mmt180 -66.85 -50.55 43.08 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 116.724 -0.217 . . . . 0.0 111.447 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.526 ' HD2' ' N ' ' A' ' 9' ' ' ARG . 59.2 Cg_endo -71.88 -26.16 19.15 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.161 1.907 . . . . 0.0 112.636 -179.789 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 53.5 m 50.78 96.72 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.157 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.512 HG21 ' HD2' ' A' ' 2' ' ' PRO . 48.7 mm . . . . . 0 C--O 1.25 1.091 0 CA-C-O 118.285 -0.864 . . . . 0.0 110.903 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 . . . . . 0 N--CA 1.487 1.386 0 CA-C-O 120.708 0.29 . . . . 0.0 111.179 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_endo -80.79 53.97 5.02 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.652 2.235 . . . . 0.0 112.589 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.721 HD12 ' N ' ' A' ' 4' ' ' LYS . 1.2 pp -88.0 -11.05 48.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.564 179.793 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.721 ' N ' HD12 ' A' ' 3' ' ' LEU . 87.4 tttt -112.63 -18.94 12.24 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.175 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -73.19 -20.47 60.88 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.094 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 62.21 83.29 0.16 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.886 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -68.77 -175.59 0.71 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.894 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.465 ' CZ2' ' CZ ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -141.39 -93.05 0.14 Allowed 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 179.927 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.483 ' N ' ' CD ' ' A' ' 10' ' ' PRO . 37.5 mmt180 -78.24 -45.79 2.15 Favored Pre-proline 0 C--N 1.326 -0.414 0 CA-C-N 116.677 -0.238 . . . . 0.0 111.392 179.523 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.483 ' CD ' ' N ' ' A' ' 9' ' ' ARG . 84.5 Cg_endo -83.94 -164.32 0.25 Allowed 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.458 2.105 . . . . 0.0 112.3 -179.898 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 52.9 m 63.01 87.98 0.1 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.862 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.8 mm . . . . . 0 C--O 1.248 0.995 0 CA-C-O 118.18 -0.914 . . . . 0.0 110.85 179.855 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 89.9 m-70 . . . . . 0 N--CA 1.486 1.356 0 CA-C-O 120.769 0.319 . . . . 0.0 111.135 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -75.27 80.02 2.59 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.525 2.15 . . . . 0.0 112.356 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.732 HD12 ' N ' ' A' ' 4' ' ' LYS . 1.2 pp -95.56 -12.03 26.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.552 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.732 ' N ' HD12 ' A' ' 3' ' ' LEU . 87.4 tttt -97.09 78.2 2.76 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.785 0.326 . . . . 0.0 110.756 179.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 179.84 -29.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.316 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 66.98 82.9 0.17 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.831 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -63.56 175.33 1.08 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.008 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.453 ' CZ2' ' CZ ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -139.29 -95.75 0.17 Allowed 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 179.942 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.502 ' HB2' ' HD3' ' A' ' 10' ' ' PRO . 37.3 mmt180 -71.41 -48.99 12.25 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.885 -0.143 . . . . 0.0 111.315 179.704 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.502 ' HD3' ' HB2' ' A' ' 9' ' ' ARG . 79.4 Cg_endo -77.73 90.78 1.23 Allowed 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 122.284 1.989 . . . . 0.0 112.373 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 53.2 m -60.48 86.86 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.884 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.8 mm . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.205 -0.902 . . . . 0.0 110.919 179.999 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 . . . . . 0 N--CA 1.486 1.335 0 CA-C-O 120.624 0.249 . . . . 0.0 111.156 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.446 ' HG3' ' CD2' ' A' ' 7' ' ' TRP . 46.3 Cg_exo -54.9 144.06 68.98 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.455 2.103 . . . . 0.0 112.262 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.64 HD12 ' C ' ' A' ' 3' ' ' LEU . 1.2 pp -133.37 6.48 3.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.817 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.404 ' HB2' ' O ' ' A' ' 3' ' ' LEU . 87.4 tttt 178.47 -32.03 0.01 OUTLIER 'General case' 0 C--O 1.231 0.099 0 CA-C-O 120.965 0.412 . . . . 0.0 111.288 179.854 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 -83.9 -31.41 25.7 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.196 -179.678 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.431 ' HA ' ' HB3' ' A' ' 2' ' ' PRO . 6.6 m-30 56.0 74.96 0.36 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.858 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.446 ' CD2' ' HG3' ' A' ' 2' ' ' PRO . 1.8 p90 -83.34 155.48 23.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.944 -179.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.456 ' CE3' ' C ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -111.14 -97.23 0.41 Allowed 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 179.954 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.512 ' N ' ' CD ' ' A' ' 10' ' ' PRO . 37.3 mmt180 -58.96 -44.51 98.99 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 120.414 0.15 . . . . 0.0 111.265 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.512 ' CD ' ' N ' ' A' ' 9' ' ' ARG . 37.4 Cg_exo -57.51 -164.44 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 122.349 2.033 . . . . 0.0 112.133 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.591 ' O ' HD13 ' A' ' 12' ' ' ILE . 53.2 m -164.07 31.16 0.08 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.883 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.591 HD13 ' O ' ' A' ' 11' ' ' SER . 48.8 mm . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.267 -0.873 . . . . 0.0 110.887 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . 0.499 ' HB2' ' HD3' ' A' ' 2' ' ' PRO . 90.1 m-70 . . . . . 0 N--CA 1.489 1.482 0 N-CA-C 111.927 0.343 . . . . 0.0 111.927 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.499 ' HD3' ' HB2' ' A' ' 1' ' ' HIS . 97.5 Cg_endo -79.78 81.46 2.76 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 122.17 1.913 . . . . 0.0 112.371 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.62 HD12 ' C ' ' A' ' 3' ' ' LEU . 1.2 pp -112.29 15.36 20.4 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.678 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -95.87 -17.8 20.83 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.216 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -103.8 -15.32 15.74 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.247 -179.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 62.54 81.62 0.2 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.86 0.362 . . . . 0.0 110.779 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -59.46 162.99 4.37 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.079 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.455 ' CE3' ' C ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -124.53 -95.58 0.46 Allowed 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 179.84 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.504 ' HB2' ' HD3' ' A' ' 10' ' ' PRO . 37.3 mmt180 -62.59 -49.29 83.77 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-N 116.874 -0.148 . . . . 0.0 111.191 179.683 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.504 ' HD3' ' HB2' ' A' ' 9' ' ' ARG . 76.3 Cg_endo -77.26 88.84 1.37 Allowed 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 122.238 1.958 . . . . 0.0 112.353 -179.96 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 52.3 m -76.57 -18.96 58.38 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.224 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.448 ' O ' HG22 ' A' ' 12' ' ' ILE . 48.8 mm . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.262 -0.875 . . . . 0.0 110.893 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . 0.519 ' HB2' ' HD3' ' A' ' 2' ' ' PRO . 90.0 m-70 . . . . . 0 N--CA 1.49 1.529 0 N-CA-C 111.852 0.315 . . . . 0.0 111.852 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.519 ' HD3' ' HB2' ' A' ' 1' ' ' HIS . 98.7 Cg_endo -79.83 83.31 2.27 Favored 'Trans proline' 0 C--N 1.349 0.565 0 C-N-CA 122.126 1.884 . . . . 0.0 112.364 -179.827 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.684 HD12 ' N ' ' A' ' 4' ' ' LYS . 1.2 pp -79.79 -9.66 59.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.613 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.684 ' N ' HD12 ' A' ' 3' ' ' LEU . 87.3 tttt -78.56 -18.75 54.2 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.758 0.313 . . . . 0.0 111.182 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.403 HE22 HD11 ' A' ' 12' ' ' ILE . 41.4 tt0 -76.49 -19.72 57.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.154 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.5 m-30 62.17 73.63 0.46 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.852 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -74.47 165.28 25.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.881 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.458 ' CE3' ' C ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -159.48 -98.26 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 -179.957 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.499 ' HB2' ' HD3' ' A' ' 10' ' ' PRO . 37.3 mmt180 -58.38 -46.57 99.62 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 120.402 0.144 . . . . 0.0 111.281 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.499 ' HD3' ' HB2' ' A' ' 9' ' ' ARG . 95.9 Cg_endo -85.2 -166.62 0.35 Allowed 'Trans proline' 0 N--CA 1.459 -0.504 0 C-N-CA 122.495 2.13 . . . . 0.0 112.305 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 53.2 m -165.65 32.05 0.05 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.862 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.487 ' O ' HG22 ' A' ' 12' ' ' ILE . 48.7 mm . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.222 -0.894 . . . . 0.0 110.894 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 . . . . . 0 N--CA 1.487 1.417 0 CA-C-O 120.676 0.274 . . . . 0.0 111.242 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -52.1 125.72 18.15 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.571 2.18 . . . . 0.0 112.25 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.638 HD12 ' C ' ' A' ' 3' ' ' LEU . 1.2 pp -125.01 1.57 7.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.717 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.5 ' N ' HD12 ' A' ' 3' ' ' LEU . 87.4 tttt -112.48 -18.5 12.41 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.768 0.318 . . . . 0.0 111.278 -179.916 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 -98.7 -20.29 17.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.098 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.51 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 6.4 m-30 62.61 18.1 10.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.207 179.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.51 ' CD1' ' O ' ' A' ' 6' ' ' TYR . 1.9 p90 42.21 -167.13 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.537 179.973 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.465 ' CE3' ' C ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -170.43 -99.51 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 -179.917 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.501 ' N ' ' CD ' ' A' ' 10' ' ' PRO . 37.3 mmt180 -66.14 -44.76 60.83 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 120.385 0.136 . . . . 0.0 111.19 179.819 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.501 ' CD ' ' N ' ' A' ' 9' ' ' ARG . 12.8 Cg_exo -70.09 -162.28 0.09 OUTLIER 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 122.478 2.118 . . . . 0.0 112.257 -179.903 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 52.6 m -164.84 31.92 0.06 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.84 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.8 mm . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.213 -0.899 . . . . 0.0 110.861 -179.958 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 . . . . . 0 N--CA 1.485 1.324 0 CA-C-O 120.779 0.323 . . . . 0.0 111.193 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -71.81 134.62 24.15 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.544 2.163 . . . . 0.0 112.302 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.669 HD12 ' C ' ' A' ' 3' ' ' LEU . 1.1 pp -90.19 2.29 55.53 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.625 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.5 ' N ' HD12 ' A' ' 3' ' ' LEU . 87.4 tttt -90.41 -16.71 28.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.825 0.345 . . . . 0.0 111.001 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -143.15 106.4 4.56 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.856 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.535 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 7.1 m-30 -86.51 9.72 17.47 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.519 179.775 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.535 ' CD1' ' O ' ' A' ' 6' ' ' TYR . 1.9 p90 44.2 -170.33 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.896 0.379 . . . . 0.0 111.558 179.89 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.458 ' CE3' ' C ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -143.91 -96.7 0.11 Allowed 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 -179.891 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.52 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 37.4 mmt180 -62.75 -50.16 79.08 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-N 116.882 -0.145 . . . . 0.0 111.3 179.833 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.52 ' HD2' ' N ' ' A' ' 9' ' ' ARG . 67.0 Cg_endo -73.91 87.28 1.17 Allowed 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.258 1.972 . . . . 0.0 112.296 179.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 52.6 m -86.6 -18.46 31.37 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.239 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.8 mm . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.248 -0.882 . . . . 0.0 110.907 -179.959 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 . . . . . 0 N--CA 1.486 1.334 0 CA-C-O 120.696 0.284 . . . . 0.0 111.164 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -70.3 103.34 1.24 Allowed 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.577 2.185 . . . . 0.0 112.311 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.615 HD12 ' C ' ' A' ' 3' ' ' LEU . 1.2 pp -100.02 16.98 22.2 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.524 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -105.51 -16.77 14.63 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.306 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 -91.81 -20.21 21.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.299 -179.833 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 60.17 75.99 0.38 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.734 -179.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -73.05 -176.17 2.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.974 -179.858 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.534 ' CH2' ' CZ ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -158.34 -96.61 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 179.745 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.534 ' CZ ' ' CH2' ' A' ' 8' ' ' TRP . 38.1 mmt180 -92.31 -48.59 0.31 Allowed Pre-proline 0 C--N 1.33 -0.242 0 N-CA-C 111.496 0.184 . . . . 0.0 111.496 178.521 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.516 ' HD3' ' HB2' ' A' ' 9' ' ' ARG . 93.4 Cg_endo -85.47 90.73 0.72 Allowed 'Trans proline' 0 C--N 1.349 0.574 0 C-N-CA 122.436 2.091 . . . . 0.0 112.424 -179.908 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 53.2 m -79.2 66.74 4.73 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.838 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.9 mm . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.254 -0.879 . . . . 0.0 110.938 179.998 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 . . . . . 0 N--CA 1.487 1.411 0 CA-C-O 120.693 0.282 . . . . 0.0 111.22 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -75.65 97.36 1.1 Allowed 'Trans proline' 0 C--N 1.343 0.264 0 C-N-CA 122.657 2.238 . . . . 0.0 112.36 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.819 HD12 ' N ' ' A' ' 4' ' ' LYS . 1.2 pp -116.6 -17.24 10.63 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.818 -179.944 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.819 ' N ' HD12 ' A' ' 3' ' ' LEU . 87.4 tttt -137.09 -14.56 1.55 Allowed 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -179.757 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 -101.69 -30.33 11.39 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.897 0.38 . . . . 0.0 111.114 -179.778 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.518 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 6.6 m-30 55.4 33.13 20.22 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.988 179.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.518 ' CD1' ' O ' ' A' ' 6' ' ' TYR . 1.9 p90 43.37 -169.05 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.51 -179.931 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.454 ' CE3' ' C ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -150.3 -95.9 0.07 Allowed 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 -179.903 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.498 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 37.3 mmt180 -71.9 -49.67 10.22 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.879 -0.146 . . . . 0.0 111.202 179.581 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.498 ' HD2' ' N ' ' A' ' 9' ' ' ARG . 71.8 Cg_endo -76.43 83.74 1.99 Allowed 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 122.281 1.988 . . . . 0.0 112.42 -179.972 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 53.4 m -103.65 138.45 40.3 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.918 -179.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.8 mm . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.276 -0.869 . . . . 0.0 110.823 -180.0 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 . . . . . 0 N--CA 1.486 1.367 0 CA-C-O 120.621 0.248 . . . . 0.0 111.201 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_exo -47.74 159.99 0.49 Allowed 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.606 2.204 . . . . 0.0 112.343 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.644 HD12 ' C ' ' A' ' 3' ' ' LEU . 1.2 pp -134.3 9.68 3.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.781 -179.926 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -127.7 -13.3 5.34 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 111.742 0.275 . . . . 0.0 111.742 -179.78 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -70.21 -31.33 68.72 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.91 0.386 . . . . 0.0 111.138 -179.822 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.9 m-30 54.67 80.52 0.12 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.041 179.91 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -104.27 161.75 13.78 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.665 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.537 ' CH2' ' CZ ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -112.31 -97.84 0.42 Allowed 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 -179.962 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.537 ' CZ ' ' CH2' ' A' ' 8' ' ' TRP . 38.1 mmt180 -88.61 -48.09 0.43 Allowed Pre-proline 0 CA--C 1.532 0.268 0 CA-C-N 116.915 -0.13 . . . . 0.0 111.292 178.709 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.495 ' HD3' ' HB2' ' A' ' 9' ' ' ARG . 91.0 Cg_endo -83.39 97.43 0.8 Allowed 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 122.391 2.061 . . . . 0.0 112.509 -179.718 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 52.8 m -80.01 141.35 36.02 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.8 179.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.7 mm . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.259 -0.877 . . . . 0.0 110.978 -179.94 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . 0.504 ' HB2' ' HD3' ' A' ' 2' ' ' PRO . 90.0 m-70 . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 111.947 0.351 . . . . 0.0 111.947 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.504 ' HD3' ' HB2' ' A' ' 1' ' ' HIS . 95.0 Cg_endo -80.46 57.8 6.69 Favored 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 122.182 1.921 . . . . 0.0 112.361 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.633 HD12 ' C ' ' A' ' 3' ' ' LEU . 1.2 pp -110.1 12.94 23.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.645 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -76.75 -18.75 58.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.765 0.317 . . . . 0.0 111.137 179.892 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.429 ' O ' ' HG2' ' A' ' 5' ' ' GLN . 41.4 tt0 -112.03 -4.2 14.55 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.269 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 65.52 91.84 0.08 Allowed 'General case' 0 C--O 1.231 0.116 0 CA-C-O 120.838 0.351 . . . . 0.0 110.812 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -65.8 -177.88 0.51 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.01 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.46 ' CE3' ' C ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -171.29 -98.12 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 179.954 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.54 ' N ' ' HD2' ' A' ' 10' ' ' PRO . 37.3 mmt180 -62.88 -55.36 38.77 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 120.354 0.121 . . . . 0.0 111.204 179.828 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.54 ' HD2' ' N ' ' A' ' 9' ' ' ARG . 19.7 Cg_endo -58.89 -76.71 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 122.267 1.978 . . . . 0.0 112.346 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 53.4 m 61.25 170.55 0.1 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.88 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.8 mm . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.846 179.978 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 89.9 m-70 . . . . . 0 N--CA 1.486 1.371 0 CA-C-O 120.641 0.258 . . . . 0.0 111.123 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_endo -78.5 56.93 6.07 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.58 2.187 . . . . 0.0 112.43 -179.879 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.611 HD12 ' C ' ' A' ' 3' ' ' LEU . 1.2 pp -113.45 16.45 18.85 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.558 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -74.57 -19.67 60.24 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.11 179.874 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.425 ' O ' ' HB2' ' A' ' 6' ' ' TYR . 41.5 tt0 -116.89 -4.6 11.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.084 179.862 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.483 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 6.2 m-30 70.32 8.32 6.58 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.503 -179.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.483 ' CD1' ' O ' ' A' ' 6' ' ' TYR . 1.9 p90 40.66 -165.0 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.819 0.342 . . . . 0.0 111.611 179.66 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.454 ' CZ2' ' CZ ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -170.5 -95.56 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 -179.991 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.495 ' HB2' ' HD3' ' A' ' 10' ' ' PRO . 37.4 mmt180 -72.84 -49.06 8.05 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 116.849 -0.159 . . . . 0.0 111.173 179.548 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.495 ' HD3' ' HB2' ' A' ' 9' ' ' ARG . 91.3 Cg_endo -78.48 81.69 2.68 Favored 'Trans proline' 0 C--N 1.349 0.557 0 C-N-CA 122.223 1.949 . . . . 0.0 112.396 -179.998 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 52.8 m -76.0 112.87 12.88 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.814 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.493 HG22 ' OXT' ' A' ' 12' ' ' ILE . 48.8 mm . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.203 -0.903 . . . . 0.0 110.952 -179.91 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.0 m-70 . . . . . 0 N--CA 1.485 1.323 0 CA-C-O 120.661 0.267 . . . . 0.0 111.261 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -67.99 124.67 12.08 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.606 2.204 . . . . 0.0 112.237 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.719 HD12 ' N ' ' A' ' 4' ' ' LYS . 1.2 pp -74.0 -10.53 59.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.646 -179.949 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.719 ' N ' HD12 ' A' ' 3' ' ' LEU . 87.4 tttt -82.5 -17.49 44.93 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.702 0.287 . . . . 0.0 111.273 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 -97.42 93.73 6.64 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.953 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.539 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 6.5 m-30 -71.14 -12.58 61.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.207 179.841 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.539 ' CD1' ' O ' ' A' ' 6' ' ' TYR . 1.9 p90 44.38 -170.69 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 120.998 0.428 . . . . 0.0 111.512 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.455 ' CE3' ' C ' ' A' ' 8' ' ' TRP . 0.0 OUTLIER -154.99 -94.91 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 -179.841 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.527 ' HB2' ' HD3' ' A' ' 10' ' ' PRO . 37.3 mmt180 -60.0 -47.07 97.92 Favored Pre-proline 0 C--N 1.328 -0.37 0 CA-C-N 116.905 -0.134 . . . . 0.0 111.129 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.527 ' HD3' ' HB2' ' A' ' 9' ' ' ARG . 2.1 Cg_endo -83.02 112.63 2.05 Favored 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.864 2.376 . . . . 0.0 112.039 -179.866 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 52.5 m -94.94 -23.06 17.58 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.098 -179.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 48.7 mm . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.24 -0.886 . . . . 0.0 110.82 179.957 . . . . . . . . 0 0 . 1 stop_ save_